Vitas-M small molecule compound
(8E)-8-(2-fluorobenzylidene)-4-(2-fluorophenyl)-6-methyl-3,4,5,6,7,8-hexahydroquinazoline-2(1H)-thione
Catalog ID
STL308252
SMILES CC1C/C(=C\c2ccccc2F)/C2=C(C1)C(NC(=S)N2)c1ccccc1F
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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 C22H20F2N2S MW 382.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20F2N2S/c1-13-10-15(12-14-6-2-4-8-18(14)23)20-17(11-13)21(26-22(27)25-20)16-7-3-5-9-19(16)24/h2-9,12-13,21H,10-11H2,1H3,(H2,25,26,27)/b15-12+InChIKey
PADDBNBWCSSZHO-NTCAYCPXSA-NSynonyms
685130-42-1(8E)4(2fluorophenyl)8((2fluorophenyl)methylidene)6methyl134567hexahydroquinazoline2thione
(8E)8(2fluorobenzylidene)4(2fluorophenyl)6methyl345678hexahydroquinazoline2(1H)thione
(E)8(2fluorobenzylidene)4(2fluorophenyl)6methyl345678hexahydroquinazoline2(1H)thione
685130421
CC1CC(=CC2=CC=CC=C2F)C3=C(C1)C(NC(=S)N3)C4=CC=CC=C4F
CC1CC(=Cc2ccccc2F)C2=C(C1)C(NC(=S)N2)c1ccccc1F
InChI=1SC22H20F2N2Sc1131015(1214624818(14)23)2017(1113)21(2622(27)2520)16735919(16)24h29121321H1011H21H3(H2252627)b1512+
MFCD03679900
ZINC000004497930
ZINC000004497938
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