Vitas-M small molecule compound
4-[(5Z)-5-(4-bromobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(2-methoxyphenyl)butanamide
Catalog ID
STK994544
SMILES COc1ccccc1NC(=O)CCCN1C(=S)S/C(=C\c2ccc(cc2)Br)/C1=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 C21H19BrN2O3S2 MW 491.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN2O3S2/c1-27-17-6-3-2-5-16(17)23-19(25)7-4-12-24-20(26)18(29-21(24)28)13-14-8-10-15(22)11-9-14/h2-3,5-6,8-11,13H,4,7,12H2,1H3,(H,23,25)/b18-13-InChIKey
NBVKNRUKHAJSOX-AQTBWJFISA-NSynonyms
4((5Z)5((4bromophenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)N(2methoxyphenyl)butanamide
4((5Z)5(4bromobenzylidene)4oxo2thioxo13thiazolidin3yl)N(2methoxyphenyl)butanamide
COC1=CC=CC=C1NC(=O)CCCN2C(=O)C(=CC3=CC=C(C=C3)Br)SC2=S
COc1ccccc1NC(=O)CCCN1C(=S)SC(=Cc2ccc(cc2)Br)C1=O
InChI=1SC21H19BrN2O3S2c12717632516(17)2319(25)74122420(26)18(2921(24)28)131481015(22)11914h235681113H4712H21H3(H2325)b1813
MFCD02655296
ZINC000008871686
ZINC08871686
ZINC8871686
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