1-(3-Chlorophenyl)-4,4,6-trimethyl-3,4-dihydropyrimidine-2(1H)-thione

被引：2

作者：

Yamin, Bohari M. ^{[1
]}

Salem, Halima Farag ^{[1
]}

机构：

[1] Univ Kebangsaan Malaysia, Sch Chem Sci & Food Technol, Bangi 43600, Selangor, Malaysia

来源：

ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE | 2011年 / 67卷

关键词：

GRAPH-SET ANALYSIS; IN-VITRO; CRYSTALS; PATTERNS;

D O I：

10.1107/S1600536810054292

中图分类号：

O7 [晶体学];

学科分类号：

0702 ; 070205 ; 0703 ; 080501 ;

摘要：

In the title compound, C13H15ClN2S, the dihydropyrimidine ring is essentially planar, with a maximum deviation from the least-squares plane of 0.122 (3) angstrom for the unsubstitued olefinic C atom. The dihedral angle between the dihydropyrimidine and benzene rings is 86.62 (13)degrees. The crystal structure is stabilized by intermolecular N-H center dot center dot center dot S hydrogen bonds, which form centrosymmetric dimers arranged along the c axis.

引用

页码：O282 / U2028

页数：9

共 15 条

[1]

Alam O, 2005, INDIAN J HETEROCY CH, V14, P293

[2]

[Anonymous], 1995, J Appl Crystallogr, DOI [10.1107/S0021889895007138, DOI 10.1107/S0021889895007138]

[3] PATTERNS IN HYDROGEN BONDING - FUNCTIONALITY AND GRAPH SET ANALYSIS IN CRYSTALS [J].

BERNSTEIN, J ;

DAVIS, RE ;

SHIMONI, L ;

CHANG, NL .

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 1995, 34 (15) :1555-1573

[4]

Bruker, 2000, SAINT and SADABS

[5]

Burnett M.N., 1996, ORTEP-III: Oak Ridge Thermal Ellipsoid Plot Program for Crystal Structure Illustrations

[6] GRAPH-SET ANALYSIS OF HYDROGEN-BOND PATTERNS IN ORGANIC-CRYSTALS [J].

ETTER, MC ;

MACDONALD, JC ;

BERNSTEIN, J .

ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE CRYSTAL ENGINEERING AND MATERIALS, 1990, 46 :256-262

[7]

Farrugia L.J., 1997, J. Appl. Crystallogr., V30, P565, DOI [10.1107/S0021889897003117, DOI 10.1107/S0021889897003117]

[8] A new triclinic polymorph of 4,5,6-trimethyl-phenyl-3,4-dihydropyrimidine-2(1H)-thione [J].

Ismail, Nur Liyana ;

Othman, Eliyanti ;

Yamin, Bohari M. .

ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2007, 63 :O2442-O2443

[9] Recent advances in the Biginelli dihydropyrimidine synthesis. New tricks from an old dog [J].

Kappe, CO .

ACCOUNTS OF CHEMICAL RESEARCH, 2000, 33 (12) :879-888

[10] Synthesis, docking, and in vitro activity of thiosemicarbazones, aminoacyl-thiosemicarbazides and acyl-thiazolidones against Trypanosoma cruzi [J].

Lima Leite, Ana Cristina ;

Souza de Lima, Renata ;

Rodrigo de M Moreira, Diogo ;

Verissimo de O. Cardoso, Marcos ;

Gouvela de Brito, Ana Carolina ;

Farias dos Santos, Luciene Maria ;

Hernandes, Marcelo Zaldini ;

Kiperstok, Alice Costa ;

Santana de Lima, Ricardo ;

Soares, Milena B. P. .

BIOORGANIC & MEDICINAL CHEMISTRY, 2006, 14 (11) :3749-3757

← 1 2 →