Vitas-M small molecule compound
2-methoxy-4-{(E)-[4-oxo-2-(phenylamino)-1,3-thiazol-5(4H)-ylidene]methyl}phenyl 2-nitrobenzenesulfonate
Catalog ID
STL406925
SMILES COc1cc(ccc1OS(=O)(=O)c1ccccc1[N+](=O)[O-])/C=C\1/SC(=NC1=O)Nc1ccccc1
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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 C23H17N3O7S2 MW 511.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3O7S2/c1-32-19-13-15(14-20-22(27)25-23(34-20)24-16-7-3-2-4-8-16)11-12-18(19)33-35(30,31)21-10-6-5-9-17(21)26(28)29/h2-14H,1H3,(H,24,25,27)/b20-14+InChIKey
XAFBUUNCUDUTTC-XSFVSMFZSA-NSynonyms
(4((E)(2anilino4oxo13thiazol5ylidene)methyl)2methoxyphenyl)2nitrobenzenesulfonate
2METHOXY4((4OXO2(PHENYLAZAMETHYLENE)(13THIAZOLIDIN5YLIDENE))METHYL)PHENYL2NITROBENZENESULFONATE
2methoxy4((E)(4oxo2(phenylamino)13thiazol5(4H)ylidene)methyl)phenyl2nitrobenzenesulfonate
COC1=C(C=CC(=C1)C=C2C(=O)N=C(S2)NC3=CC=CC=C3)OS(=O)(=O)C4=CC=CC=C4(N+)(=O)(O)
COc1cc(ccc1OS(=O)(=O)c1ccccc1(N+)(=O)(O))C=C1SC(=NC1=O)Nc1ccccc1
InChI=1SC23H17N3O7S2c132191315(142022(27)2523(3420)24167324816)111218(19)3335(3031)211065917(21)26(28)29h214H1H3(H242527)b2014+
MFCD30704585
ZINC000009310385
ZINC09310385
ZINC9310385
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