Vitas-M small molecule compound
(8E)-8-(2,4-dichlorobenzylidene)-4-(2,4-dichlorophenyl)-3,4,5,6,7,8-hexahydroquinazoline-2(1H)-thione
Catalog ID
STK993751
SMILES Clc1ccc(c(c1)Cl)/C=C/1\CCCC2=C1NC(=S)NC2c1ccc(cc1Cl)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 C21H16Cl4N2S MW 470.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16Cl4N2S/c22-13-5-4-11(17(24)9-13)8-12-2-1-3-16-19(12)26-21(28)27-20(16)15-7-6-14(23)10-18(15)25/h4-10,20H,1-3H2,(H2,26,27,28)/b12-8+InChIKey
AXHXMKCLSMBUIF-XYOKQWHBSA-NSynonyms
(8E)4(24dichlorophenyl)8((24dichlorophenyl)methylidene)134567hexahydroquinazoline2thione
(8E)8(24dichlorobenzylidene)4(24dichlorophenyl)345678hexahydroquinazoline2(1H)thione
C1CC(=CC2=C(C=C(C=C2)Cl)Cl)C3=C(C1)C(NC(=S)N3)C4=C(C=C(C=C4)Cl)Cl
Clc1ccc(c(c1)Cl)C=C1CCCC2=C1NC(=S)NC2c1ccc(cc1Cl)Cl
InChI=1SC21H16Cl4N2Sc22135411(17(24)913)8122131619(12)2621(28)2720(16)157614(23)1018(15)25h41020H13H2(H2262728)b128+
MFCD01085859
ZINC000002066680
ZINC000051330515
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