Cover Image

3-(2-Hydroxyethyl)-3-methyl-1-(4-methylbenzoyl)thiourea

The title thiourea derivative, C12H16N2O2S, has a twisted conformation with the dihedral angle between the NC(=S)N and O=CC6 planes being 35.45 (5)°. The observed conformation allows for an intramolecular N-H...O hydrogen bond. In the molecular packing, supramolecular aggregation is based on hy...

Full description

Saved in:

Bibliographic Details
Main Authors:	Nazzatush Shimar Jamaludin,, Siti Nadiah Abdul Halim,, Tiekink, Edward R. T. *
Format:	Article
Language:	English
Published:	International Union of Crystallography 2016
Subjects:	QD Chemistry
Online Access:	http://eprints.sunway.edu.my/663/1/IUCrData%202016%201%20x152457.pdf http://eprints.sunway.edu.my/663/ http://dx.doi.org/10.1107/S2414314615024578
Tags:	Add Tag No Tags, Be the first to tag this record!

Similar Items

3,3-Bis(2-hydroxyethyl)-1-(4-nitrobenzoyl)thiourea: crystal structure, Hirshfeld surface analysis and computational study
by: Tan, Sang Loon *, et al.
Published: (2020)

1-[N-Methyl-N-(Phenyl)amino]-3- (4-Methylphenyl)Thiourea
by: Yeo, Chien Ing *, et al.
Published: (2019)

3,3-Bis(2-hydroxyethyl)-1-[(4-methylphenyl)carbonyl]thiourea: crystal structure, Hirshfeld surface analysis and computational study
by: Tan, Sang Loon *, et al.
Published: (2019)

Crystal structure of 1-(4-chlorophenyl)-3-[methyl(phenyl)amino]thiourea, C14H14ClN3S
by: Yeo, Chien Ing *, et al.
Published: (2019)

Systematic structural derivations of bis-hydroxyethyl thiourea – a crystallographic and computational studies
by: Tan, Sang Loon *, et al.
Published: (2019)

Crystal structure of 1-(4-methylphenyl)-3-(propan-2-ylideneamino)thiourea
by: Jotani, Mukesh M., et al.
Published: (2015)

Crystal structure of 3-methyl-1-[(E)-(4-phenylbutan-2-ylidene)amino]thiourea, C12H17N3S
by: Tan, Ming Yueh, et al.
Published: (2020)

Crystal structures of the 1:1 salts of 2-amino-4-nitrobenzoate with each of (2-hydroxyethyl)dimethylazanium, tert-butyl(2-hydroxyethyl)azanium and 1,3-dihydroxy-2-(hydroxymethyl)propan-2-aminium
by: Wardell, James L., et al.
Published: (2018)

3-Methyl-1-{(E)-[1-(4-methylpyridin-2-yl)ethylidene]amino}thiourea: crystal structure and Hirshfeld surface analysis
by: Lai, Lee Chin, et al.
Published: (2018)

3-(2-Hydroxyphenyl)-1-{(E)-[1-(pyrazin- 2-yl)ethylidene]amino}thiourea monohydrate
by: Abdullah, Erna Normaya, et al.
Published: (2011)

Synthesis, characterization crystal and molecular structure studies of 5-(3-methylbenzoyl)-4-methyl-1,3,4,5-tetrahydro-2h-1,5-benzodiazepin-2-one: hirshfeld surface analysis and DFT calculations
by: Naveena, S., et al.
Published: (2019)

1-(4-Chlorobutanoyl)-3-(2-nitrophenyl)thiourea
by: Ngah, Nurziana, et al.
Published: (2012)

1-(4-Chlorobutanoyl)-3-(2-chlorophenyl)thiourea
by: Mohd Yusof , Mohd Sukeri, et al.
Published: (2012)

An unprecedented binuclear cadmium dithiocarbamate adduct: bis[μ2-N-(2-hydroxyethyl)-N-isopropylcarbamodithioato-κ3S:S,S′]bis{[N-(2-hydroxyethyl)-N-isopropylcarbamodithioato-κ2S,S′](3-{(1E)-[(E)-2-(pyridin-3-ylmethylidene)hydrazin-1-ylidene]methyl}pyridine-κN)cadmium]} dihydrate
by: Arman, Hadi D., et al.
Published: (2016)

3-{(E)-[1-(2-Hydroxyphenyl)ethylidene]-amino}-1-(2-methylphenyl)thiourea
by: Abdus, Salam, et al.
Published: (2011)

1-Cyclohexyl-3-{(E)-[1-(pyridin-2-yl)- ethylidene]amino}thiourea
by: Fasihuddin B., Ahmad, et al.
Published: (2011)

1-(2-Hydroxyethyl)imidazolidine-2-thione
by: Lee, See Mun *, et al.
Published: (2018)

1-(Biphenyl-4-ylcarbonyl)-3-(2-chloro-4-nitrophenyl)thiourea
by: Mohd Yusof , Mohd Sukeri, et al.
Published: (2012)

Bis[N-2-hydroxyethyl,N-methyldithiocarbamato-κ2 S,S)'-4-{[(pyridin-4-ylmethylidene)hydrazinylidene}methyl]pyridine-κN 1)zinc(II): crystal structure and Hirshfeld surface analysis
by: Broker, Grant A., et al.
Published: (2017)

Crystal structure of 3-ethyl-1-[(E)-[(2E)-3-phenylprop-2-en-1-ylidene]amino]thiourea, C12H15N3S
by: Tan, Ming Yueh, et al.
Published: (2020)

A triclinic polymorph of bis(μ-N,N-bis(2-hydroxyethyl)dithiocarbamato-κ3S,S′:S′) bis(N,N-bis(2-hydroxyethyl)dithiocarbamato-κ2S:S′)zinc(II), C20H40N4O8S8Zn2
by: Poplaukhin, Pavel, et al.
Published: (2018)

Ethyl 3-amino-4-[(2-hydroxyethyl)amino]benzoate
by: Arumugam, Natarajan, et al.
Published: (2010)

Crystal structure of 5-(adamantan-1-yl)-3-[(4-{[2-(trifluoromethyl)phenyl]-methyl}piperazin-1-yl)methyl]-1,3,4-oxadiazole-2(3H)-thione, C25H31F3N4OS
by: Al-Wahabi, Lamya H., et al.
Published: (2023)

1-Butyl-1-chloro-3-methyl-3H-2,1λ4-benzoxatellurole: crystal structure and Hirshfeld analysis
by: Zukerman-Schpector, Julio, et al.
Published: (2017)

3-Acetyl-2-methyl-4-phenylquinolin-1-ium chloride
by: Tan, Kong Wai, et al.
Published: (2010)

1-Methyl-3,3-bis[(4-methylphenyl)sulfanyl]piperidin-2-one
by: Zukerman-Schpector, Julio, et al.
Published: (2011)

Co-crystallization of a neutral molecule and its zwitterionic tautomer: structure and Hirshfeld surface analysis of 5-methyl-4-(5-methyl-1H-pyrazol-3-yl)-2-phenyl-2,3-dihydro-1H-pyrazol-3-one 5-methyl-4-(5-methyl-1H-pyrazol-2-ium-3-yl)-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-1-ide monohydrate
by: Asiri, Abdullah M., et al.
Published: (2019)

Crystal structure of the (E)-O-methyl-N-phenyl-thiocarbamate – 4,4′-bipyridine (1/1), C18H17N3OS
by: Yeo, Chien Ing *, et al.
Published: (2018)

1-Anilino-5-methyl-1H-1,2,3-triazole-4-carbaldehyde
by: Cunha, Anna C., et al.
Published: (2016)

Phosphane gold(i), silver(i) and copper(i) dithiocarbamates: Synthesis, characterization, anti-cancer and anti-bacterial studies / Nazzatush Shimar Jamaludin
by: Nazzatush Shimar, Jamaludin
Published: (2015)

Crystal structure of (4,4′-bipyridyl-κN)bis[N-(2-hydroxyethyl)-N-isopropyldithiocarbamato-κ2 S,S′]zinc(II)–4,4′-bipyridyl (2/1) and its isostructural cadmium(II) analogue
by: Tan, Yee Seng *, et al.
Published: (2017)

Crystal structure of 3-(adamantan-1-yl)-4-methyl-5-{[(4-nitrophenyl)methyl]-sulfanyl}-4H-1,2,4-triazole, C20H24N4O2S
by: Al-Wahaibi, Lamya H., et al.
Published: (2022)

Crystal structure of 3-[methyl(phenyl)amino]-1-phenylthiourea, C14H15N3S
by: Yeo, Chien Ing *, et al.
Published: (2019)

A kryptoracemic salt: 2-{[2,8-bis(triﬂuoromethyl)quinolin-4yl](hydroxy)methyl}piperidin-1-ium (+)-3,3,3-triﬂuoro-2-methoxy-2-phenylpropanoate
by: Wardell, James L., et al.
Published: (2016)

Crystal structure of ethyl 4-methyl-2-oxo-5-phenyl-1,3,4-oxadiazinane-3-carboxylate, C13H16N2O4
by: Caracelli, Ignez, et al.
Published: (2020)

Reactivity of the metalloligand [Pt2(µ-S)2(PPh3)4] toward tellurium(II) thiourea complexes: synthesis and structural characterization of the ditellurium(I) derivative [{Pt2(µ-S)2(PPh3)4}2Te2]2+
by: Fortney-Zirker, Ryland G., et al.
Published: (2018)

Crystal structure of 5-(adamantan-1-yl)-3-[(4-trifluoromethylanilino)methyl]-2,3-dihydro-1,3,4-oxadiazole-2-thione, C20H22F3N3OS
by: Al-Wahaibi, Lamya H., et al.
Published: (2022)

4-(4-Acetyl-5-methyl-1H-1,2,3-triazol-1-yl)benzonitrile: crystal structure and Hirshfeld surface analysis
by: Zukerman-Schpector, Julio, et al.
Published: (2018)

Methyl 3-[(1-benzyl-4-phenyl-1H-1,2,3-triazol-5-yl)formamido]propanoate: crystal structure, Hirshfeld surface analysis and computational chemistry
by: Caracelli, Ignez, et al.
Published: (2020)

Crystal structures of (2,2′-bipyridyl-κ2N,N′)bis[N,N-bis(2-hydroxyethyl)dithiocarbamato-κ2S,S′]zinc dihydrate and (2,2′-bipyridyl-κ2N,N′)bis[N-(2-hydroxyethyl)-N-isopropyldithiocarbamato-κ2S,S′]zinc
by: Siti Artikah M. Safbri,, et al.
Published: (2016)