Vitas-M small molecule compound
4-(2,5-dimethyl-3-{(E)-[3-(4-nitrobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}-1H-pyrrol-1-yl)benzoic acid
Catalog ID
STL381175
SMILES OC(=O)c1ccc(cc1)n1c(C)cc(c1C)/C=C\1/SC(=O)N(C1=O)Cc1ccc(cc1)[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 C24H19N3O6S MW 477.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19N3O6S/c1-14-11-18(15(2)26(14)19-9-5-17(6-10-19)23(29)30)12-21-22(28)25(24(31)34-21)13-16-3-7-20(8-4-16)27(32)33/h3-12H,13H2,1-2H3,(H,29,30)/b21-12+InChIKey
UAEKTFRFJQMTLZ-CIAFOILYSA-NSynonyms
4(25dimethyl3((E)(3((4nitrophenyl)methyl)24dioxo13thiazolidin5ylidene)methyl)pyrrol1yl)benzoicacid
4(25dimethyl3((E)(3(4nitrobenzyl)24dioxo13thiazolidin5ylidene)methyl)1Hpyrrol1yl)benzoicacid
CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)O)C)C=C3C(=O)N(C(=O)S3)CC4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC24H19N3O6Sc1141118(15(2)26(14)199517(61019)23(29)30)122122(28)25(24(31)3421)13163720(8416)27(32)33h312H13H212H3(H2930)b2112+
MFCD07546747
OC(=O)c1ccc(cc1)n1c(C)cc(c1C)C=C1SC(=O)N(C1=O)Cc1ccc(cc1)(N+)(=O)(O)
ZINC000009235173
ZINC9235173
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