Vitas-M small molecule compound
(2E,9E)-9-(2-chlorobenzylidene)-5-(2-chlorophenyl)-2-(4-fluorobenzylidene)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazolin-3(2H)-one
Catalog ID
STL115160
SMILES Fc1ccc(cc1)/C=c\1/sc2=NC3=C(C(n2c1=O)c1ccccc1Cl)CCC/C/3=C\c1ccccc1Cl
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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 C30H21Cl2FN2OS MW 547.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H21Cl2FN2OS/c31-24-10-3-1-6-19(24)17-20-7-5-9-23-27(20)34-30-35(28(23)22-8-2-4-11-25(22)32)29(36)26(37-30)16-18-12-14-21(33)15-13-18/h1-4,6,8,10-17,28H,5,7,9H2/b20-17+,26-16+InChIKey
ZPKVNBKTDNRIOF-MZAGVPKVSA-NSynonyms
(2E9E)5(2chlorophenyl)9((2chlorophenyl)methylidene)2((4fluorophenyl)methylidene)5678tetrahydro(13)thiazolo(23b)quinazolin3one
(2E9E)9(2chlorobenzylidene)5(2chlorophenyl)2(4fluorobenzylidene)6789tetrahydro5H(13)thiazolo(23b)quinazolin3(2H)one
C1CC(=CC2=CC=CC=C2Cl)C3=C(C1)C(N4C(=O)C(=CC5=CC=C(C=C5)F)SC4=N3)C6=CC=CC=C6Cl
Fc1ccc(cc1)C=c1sc2=NC3=C(C(n2c1=O)c1ccccc1Cl)CCCC3=Cc1ccccc1Cl
InChI=1SC30H21Cl2FN2OSc31241031619(24)17207592327(20)343035(28(23)228241125(22)32)29(36)26(3730)1618121421(33)151318h1468101728H579H2b2017+2616+
MFCD03177114
ZINC000096022390
ZINC000097970839
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