Vitas-M small molecule compound
4-[(E)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-ethoxyphenyl 4-methylbenzenesulfonate
Catalog ID
STK020645
SMILES CCOc1cc(ccc1OS(=O)(=O)c1ccc(cc1)C)/C=C\1/SC(=S)N(C1=O)Cc1ccccc1
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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 C26H23NO5S3 MW 525.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23NO5S3/c1-3-31-23-15-20(11-14-22(23)32-35(29,30)21-12-9-18(2)10-13-21)16-24-25(28)27(26(33)34-24)17-19-7-5-4-6-8-19/h4-16H,3,17H2,1-2H3/b24-16+InChIKey
LTYZLSPCAQNXHO-LFVJCYFKSA-NSynonyms
(4((E)(3BENZYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)2ETHOXYPHENYL)4METHYLBENZENESULFONATE
4((E)(3BENZYL4OXO2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)2ETHOXYPHENYL4METHYLBENZENESULFONATE
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC3=CC=CC=C3)OS(=O)(=O)C4=CC=C(C=C4)C
CCOc1cc(ccc1OS(=O)(=O)c1ccc(cc1)C)C=C1SC(=S)N(C1=O)Cc1ccccc1
InChI=1SC26H23NO5S3c1331231520(111422(23)3235(2930)2112918(2)101321)162425(28)27(26(33)3424)17197546819h416H317H212H3b2416+
MFCD02122216
STK020645
ZINC000002962829
ZINC2962829
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