Vitas-M small molecule compound

2-{(5E)-5-[(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}-N-phenylacetamide

Catalog ID
STL379244
SMILES O=C(CN1C(=O)S/C(=C/c2ccc3c(c2)n(C)c(=O)n3C)/C1=O)Nc1ccccc1

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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 C21H18N4O4S MW 422.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O4S/c1-23-15-9-8-13(10-16(15)24(2)20(23)28)11-17-19(27)25(21(29)30-17)12-18(26)22-14-6-4-3-5-7-14/h3-11H,12H2,1-2H3,(H,22,26)/b17-11+
InChIKey
DNBHZMVBWIDXQZ-GZTJUZNOSA-N
Synonyms

2((5E)5((13dimethyl2oxo23dihydro1Hbenzimidazol5yl)methylidene)24dioxo13thiazolidin3yl)Nphenylacetamide
2((5E)5((13DIMETHYL2OXOBENZIMIDAZOL5YL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)NPHENYLACETAMIDE
2(5((13DIMETHYL2OXO(3HYDROBENZIMIDAZOL5YL))METHYLENE)24DIOXO(13THIAZOLIDIN3YL))NPHENYLACETAMIDE
2(5((13DIMETHYL2OXO23DIHYDRO1HBENZIMIDAZOL5YL)METHYLENE)24DIOXO13THIAZOLIDIN3YL)NPHENYLACETAMIDE
CN1C2=C(C=C(C=C2)C=C3C(=O)N(C(=O)S3)CC(=O)NC4=CC=CC=C4)N(C1=O)C
InChI=1SC21H18N4O4Sc123159813(1016(15)24(2)20(23)28)111719(27)25(21(29)3017)1218(26)22146435714h311H12H212H3(H2226)b1711+
MFCD03847639
O=C(CN1C(=O)SC(=Cc2ccc3c(c2)n(C)c(=O)n3C)C1=O)Nc1ccccc1
ZINC000001012870
ZINC01012870
ZINC1012870

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.