Vitas-M small molecule compound
4-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenyl 2-nitrobenzenesulfonate
Catalog ID
STK089534
SMILES C=CCN1C(=S)S/C(=C\c2ccc(cc2)OS(=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 C19H14N2O6S3 MW 462.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14N2O6S3/c1-2-11-20-18(22)16(29-19(20)28)12-13-7-9-14(10-8-13)27-30(25,26)17-6-4-3-5-15(17)21(23)24/h2-10,12H,1,11H2/b16-12-InChIKey
SCWBBEONZWYUNH-VBKFSLOCSA-NSynonyms
(4((Z)(4OXO3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)2NITROBENZENESULFONATE
4((Z)(4OXO3(PROP2EN1YL)2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENYL2NITROBENZENESULFONATE
C=CCN1C(=O)C(=CC2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC=C3(N+)(=O)(O))SC1=S
C=CCN1C(=S)SC(=Cc2ccc(cc2)OS(=O)(=O)c2ccccc2(N+)(=O)(O))C1=O
InChI=1SC19H14N2O6S3c12112018(22)16(2919(20)28)12137914(10813)2730(2526)17643515(17)21(23)24h21012H111H2b1612
MFCD03227413
STK089534
ZINC000002961496
ZINC02961496
ZINC2961496
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