Vitas-M small molecule compound
2-methoxy-4-[(E)-(4-oxo-3-phenyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 2-nitrobenzenesulfonate
Catalog ID
STK048451
SMILES COc1cc(ccc1OS(=O)(=O)c1ccccc1[N+](=O)[O-])/C=C\1/SC(=S)N(C1=O)c1ccccc1
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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 C23H16N2O7S3 MW 528.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16N2O7S3/c1-31-19-13-15(14-20-22(26)24(23(33)34-20)16-7-3-2-4-8-16)11-12-18(19)32-35(29,30)21-10-6-5-9-17(21)25(27)28/h2-14H,1H3/b20-14+InChIKey
ZWSWAFPYZCAZBD-XSFVSMFZSA-NSynonyms
(2METHOXY4((E)(4OXO3PHENYL2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)2NITROBENZENESULFONATE
2METHOXY4((4OXO3PHENYL2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)PHENYL2NITROBENZENESULFONATE
2METHOXY4((E)(4OXO3PHENYL2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENYL2NITROBENZENESULFONATE
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)C3=CC=CC=C3)OS(=O)(=O)C4=CC=CC=C4(N+)(=O)(O)
COc1cc(ccc1OS(=O)(=O)c1ccccc1(N+)(=O)(O))C=C1SC(=S)N(C1=O)c1ccccc1
InChI=1SC23H16N2O7S3c131191315(142022(26)24(23(33)3420)167324816)111218(19)3235(2930)211065917(21)25(27)28h214H1H3b2014+
MFCD02122250
STK048451
ZINC000100314933
ZINC100314933
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