Vitas-M small molecule compound
(5E)-5-[(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)methylidene]-3-(3-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Catalog ID
STK151664
SMILES O=C1S/C(=C/c2ccc3c(c2)n(C)c(=O)n3C)/C(=O)N1Cc1cccc(c1)[N+](=O)[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 C20H16N4O5S MW 424.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N4O5S/c1-21-15-7-6-12(9-16(15)22(2)19(21)26)10-17-18(25)23(20(27)30-17)11-13-4-3-5-14(8-13)24(28)29/h3-10H,11H2,1-2H3/b17-10+InChIKey
SPKYECWPZRXKIG-LICLKQGHSA-NSynonyms
(5E)5((13DIMETHYL2OXO23DIHYDRO1HBENZIMIDAZOL5YL)METHYLIDENE)3(3NITROBENZYL)13THIAZOLIDINE24DIONE
(5E)5((13DIMETHYL2OXOBENZIMIDAZOL5YL)METHYLIDENE)3((3NITROPHENYL)METHYL)13THIAZOLIDINE24DIONE
CN1C2=C(C=C(C=C2)C=C3C(=O)N(C(=O)S3)CC4=CC(=CC=C4)(N+)(=O)(O))N(C1=O)C
InChI=1SC20H16N4O5Sc121157612(916(15)22(2)19(21)26)101718(25)23(20(27)3017)111343514(813)24(28)29h310H11H212H3b1710+
MFCD06253183
O=C1SC(=Cc2ccc3c(c2)n(C)c(=O)n3C)C(=O)N1Cc1cccc(c1)(N+)(=O)(O)
ZINC000009720555
ZINC09720555
ZINC9720555
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