Vitas-M small molecule compound
2-[(5E)-5-{[5-(2-bromo-4-nitrophenyl)furan-2-yl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(4-methylphenyl)acetamide
Catalog ID
STK116139
SMILES O=C(CN1C(=O)S/C(=C/c2ccc(o2)c2ccc(cc2Br)[N+](=O)[O-])/C1=O)Nc1ccc(cc1)C
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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 C23H16BrN3O6S MW 542.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16BrN3O6S/c1-13-2-4-14(5-3-13)25-21(28)12-26-22(29)20(34-23(26)30)11-16-7-9-19(33-16)17-8-6-15(27(31)32)10-18(17)24/h2-11H,12H2,1H3,(H,25,28)/b20-11+InChIKey
CFTPSBBJIHMGSI-RGVLZGJSSA-NSynonyms
2((5E)5((5(2BROMO4NITROPHENYL)FURAN2YL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)N(4METHYLPHENYL)ACETAMIDE
CC1=CC=C(C=C1)NC(=O)CN2C(=O)C(=CC3=CC=C(O3)C4=C(C=C(C=C4)(N+)(=O)(O))Br)SC2=O
InChI=1SC23H16BrN3O6Sc1132414(5313)2521(28)122622(29)20(3423(26)30)11167919(3316)178615(27(31)32)1018(17)24h211H12H21H3(H2528)b2011+
MFCD04277822
O=C(CN1C(=O)SC(=Cc2ccc(o2)c2ccc(cc2Br)(N+)(=O)(O))C1=O)Nc1ccc(cc1)C
ZINC000100342963
ZINC100342963
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