Vitas-M small molecule compound
5-{(E)-[3-(3-bromophenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STL380616
SMILES Brc1cccc(c1)N1C(=S)S/C(=C/c2ccc3c(c2)n(C)c(=O)n3C)/C1=O
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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 C19H14BrN3O2S2 MW 460.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14BrN3O2S2/c1-21-14-7-6-11(8-15(14)22(2)18(21)25)9-16-17(24)23(19(26)27-16)13-5-3-4-12(20)10-13/h3-10H,1-2H3/b16-9+InChIKey
KXZYGTXDIFADGO-CXUHLZMHSA-NSynonyms
(5E)3(3bromophenyl)5((13dimethyl2oxobenzimidazol5yl)methylidene)2sulfanylidene13thiazolidin4one
5((E)(3(3bromophenyl)4oxo2thioxo13thiazolidin5ylidene)methyl)13dimethyl13dihydro2Hbenzimidazol2one
Brc1cccc(c1)N1C(=S)SC(=Cc2ccc3c(c2)n(C)c(=O)n3C)C1=O
CN1C2=C(C=C(C=C2)C=C3C(=O)N(C(=S)S3)C4=CC(=CC=C4)Br)N(C1=O)C
InChI=1SC19H14BrN3O2S2c121147611(815(14)22(2)18(21)25)91617(24)23(19(26)2716)1353412(20)1013h310H12H3b169+
MFCD03906050
ZINC000009233477
ZINC09233477
ZINC9233477
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