Vitas-M small molecule compound
4-[(E)-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 4-methylbenzenesulfonate
Catalog ID
STK050058
SMILES CCN1C(=S)S/C(=C/c2ccc(c(c2)OC)OS(=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 C20H19NO5S3 MW 449.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO5S3/c1-4-21-19(22)18(28-20(21)27)12-14-7-10-16(17(11-14)25-3)26-29(23,24)15-8-5-13(2)6-9-15/h5-12H,4H2,1-3H3/b18-12+InChIKey
MYMUCCDSHLADFQ-LDADJPATSA-NSynonyms
(4((E)(3ETHYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)2METHOXYPHENYL)4METHYLBENZENESULFONATE
4((E)(3ETHYL4OXO2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)2METHOXYPHENYL4METHYLBENZENESULFONATE
CCN1C(=O)C(=CC2=CC(=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)C)OC)SC1=S
CCN1C(=S)SC(=Cc2ccc(c(c2)OC)OS(=O)(=O)c2ccc(cc2)C)C1=O
InChI=1SC20H19NO5S3c142119(22)18(2820(21)27)121471016(17(1114)253)2629(2324)158513(2)6915h512H4H213H3b1812+
MFCD02121004
STK050058
ZINC000006470533
ZINC06470533
ZINC6470533
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