Vitas-M small molecule compound
2-[(Z)-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 2-nitrobenzenesulfonate
Catalog ID
STK091954
SMILES CCN1C(=S)S/C(=C\c2ccccc2OS(=O)(=O)c2ccccc2[N+](=O)[O-])/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 C18H14N2O6S3 MW 450.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O6S3/c1-2-19-17(21)15(28-18(19)27)11-12-7-3-5-9-14(12)26-29(24,25)16-10-6-4-8-13(16)20(22)23/h3-11H,2H2,1H3/b15-11-InChIKey
MXHIENAJNZYDFX-PTNGSMBKSA-NSynonyms
(2((Z)(3ETHYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)2NITROBENZENESULFONATE
2((Z)(3ETHYL4OXO2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENYL2NITROBENZENESULFONATE
CCN1C(=O)C(=CC2=CC=CC=C2OS(=O)(=O)C3=CC=CC=C3(N+)(=O)(O))SC1=S
CCN1C(=S)SC(=Cc2ccccc2OS(=O)(=O)c2ccccc2(N+)(=O)(O))C1=O
InChI=1SC18H14N2O6S3c121917(21)15(2818(19)27)1112735914(12)2629(2425)161064813(16)20(22)23h311H2H21H3b1511
MFCD03227517
STK091954
ZINC000002959741
ZINC02959741
ZINC2959741
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