Vitas-M small molecule compound
2-bromo-6-methoxy-4-[(E)-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl thiophene-2-carboxylate
Catalog ID
STK393526
SMILES COc1cc(/C=C\2/SC(=S)NC2=O)cc(c1OC(=O)c1cccs1)Br
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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 C16H10BrNO4S3 MW 456.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10BrNO4S3/c1-21-10-6-8(7-12-14(19)18-16(23)25-12)5-9(17)13(10)22-15(20)11-3-2-4-24-11/h2-7H,1H3,(H,18,19,23)/b12-7+InChIKey
ZFYSGVAYMKFLDA-KPKJPENVSA-NSynonyms
(2BROMO6METHOXY4((E)(4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)THIOPHENE2CARBOXYLATE
2bromo6methoxy4((E)(4oxo2thioxo13thiazolidin5ylidene)methyl)phenylthiophene2carboxylate
COC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)S2)Br)OC(=O)C3=CC=CS3
COc1cc(C=C2SC(=S)NC2=O)cc(c1OC(=O)c1cccs1)Br
InChI=1SC16H10BrNO4S3c1211068(71214(19)1816(23)2512)59(17)13(10)2215(20)113242411h27H1H3(H181923)b127+
MFCD03144335
ZINC000002990781
ZINC02990781
ZINC2990781
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