Vitas-M small molecule compound
1,3-dimethyl-5-[(Z)-{4-oxo-2-thioxo-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-5-ylidene}methyl]-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STL428728
SMILES S=C1S/C(=C\c2ccc3c(c2)n(C)c(=O)n3C)/C(=O)N1c1cccc(c1)C(F)(F)F
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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 C20H14F3N3O2S2 MW 449.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14F3N3O2S2/c1-24-14-7-6-11(8-15(14)25(2)18(24)28)9-16-17(27)26(19(29)30-16)13-5-3-4-12(10-13)20(21,22)23/h3-10H,1-2H3/b16-9-InChIKey
XAIOGHCUMSOWMB-SXGWCWSVSA-NSynonyms
(5Z)5((13dimethyl2oxobenzimidazol5yl)methylidene)2sulfanylidene3(3(trifluoromethyl)phenyl)13thiazolidin4one
13dimethyl5((Z)(4oxo2thioxo3(3(trifluoromethyl)phenyl)13thiazolidin5ylidene)methyl)13dihydro2Hbenzimidazol2one
CN1C2=C(C=C(C=C2)C=C3C(=O)N(C(=S)S3)C4=CC=CC(=C4)C(F)(F)F)N(C1=O)C
InChI=1SC20H14F3N3O2S2c124147611(815(14)25(2)18(24)28)91617(27)26(19(29)3016)1353412(1013)20(2122)23h310H12H3b169
MFCD30710658
S=C1SC(=Cc2ccc3c(c2)n(C)c(=O)n3C)C(=O)N1c1cccc(c1)C(F)(F)F
ZINC000108605033
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