Vitas-M small molecule compound
(8E)-8-(4-chlorobenzylidene)-4-(4-chlorophenyl)-3,4,5,6,7,8-hexahydroquinazoline-2(1H)-thione
Catalog ID
STK993159
SMILES Clc1ccc(cc1)/C=C/1\CCCC2=C1NC(=S)NC2c1ccc(cc1)Cl
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H18Cl2N2S MW 401.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18Cl2N2S/c22-16-8-4-13(5-9-16)12-15-2-1-3-18-19(24-21(26)25-20(15)18)14-6-10-17(23)11-7-14/h4-12,19H,1-3H2,(H2,24,25,26)/b15-12+InChIKey
KVSPYRASURNEPV-NTCAYCPXSA-NSynonyms
833488-23-6(8E)4(4chlorophenyl)8((4chlorophenyl)methylidene)134567hexahydroquinazoline2thione
(8E)8(4chlorobenzylidene)4(4chlorophenyl)345678hexahydroquinazoline2(1H)thione
(E)8(4chlorobenzylidene)4(4chlorophenyl)345678hexahydroquinazoline2(1H)thione
833488236
C1CC(=CC2=CC=C(C=C2)Cl)C3=C(C1)C(NC(=S)N3)C4=CC=C(C=C4)Cl
Clc1ccc(cc1)C=C1CCCC2=C1NC(=S)NC2c1ccc(cc1)Cl
InChI=1SC21H18Cl2N2Sc22168413(5916)12152131819(2421(26)2520(15)18)1461017(23)11714h41219H13H2(H2242526)b1512+
MFCD00564699
ZINC000013686752
ZINC000013686758
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