Vitas-M small molecule compound
4-bromo-2-[(Z)-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzenesulfonate
Catalog ID
STK015604
SMILES CCN1C(=S)S/C(=C\c2cc(Br)ccc2OS(=O)(=O)c2ccc(cc2)C)/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 C19H16BrNO4S3 MW 498.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16BrNO4S3/c1-3-21-18(22)17(27-19(21)26)11-13-10-14(20)6-9-16(13)25-28(23,24)15-7-4-12(2)5-8-15/h4-11H,3H2,1-2H3/b17-11-InChIKey
LYPGOEVRWNZEMT-BOPFTXTBSA-NSynonyms
(4BROMO2((Z)(3ETHYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)4METHYLBENZENESULFONATE
4BROMO2((Z)(3ETHYL4OXO2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENYL4METHYLBENZENESULFONATE
CCN1C(=O)C(=CC2=C(C=CC(=C2)Br)OS(=O)(=O)C3=CC=C(C=C3)C)SC1=S
CCN1C(=S)SC(=Cc2cc(Br)ccc2OS(=O)(=O)c2ccc(cc2)C)C1=O
InChI=1SC19H16BrNO4S3c132118(22)17(2719(21)26)11131014(20)6916(13)2528(2324)157412(2)5815h411H3H212H3b1711
MFCD03227529
STK015604
ZINC000002961534
ZINC02961534
ZINC2961534
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