Vitas-M small molecule compound

4-[(Z)-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 2-nitrobenzenesulfonate

Catalog ID
STK086849
SMILES S=C1NC(=O)/C(=C/c2ccc(cc2)OS(=O)(=O)c2ccccc2[N+](=O)[O-])/S1

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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 C16H10N2O6S3 MW 422.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10N2O6S3/c19-15-13(26-16(25)17-15)9-10-5-7-11(8-6-10)24-27(22,23)14-4-2-1-3-12(14)18(20)21/h1-9H,(H,17,19,25)/b13-9-
InChIKey
YWXOPSPBBBUBRO-LCYFTJDESA-N
Synonyms

(4((Z)(4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)2NITROBENZENESULFONATE
4((Z)(4OXO2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENYL2NITROBENZENESULFONATE
C1=CC=C(C(=C1)(N+)(=O)(O))S(=O)(=O)OC2=CC=C(C=C2)C=C3C(=O)NC(=S)S3
InChI=1SC16H10N2O6S3c191513(2616(25)1715)9105711(8610)2427(2223)14421312(14)18(20)21h19H(H171925)b139
MFCD03227746
S=C1NC(=O)C(=Cc2ccc(cc2)OS(=O)(=O)c2ccccc2(N+)(=O)(O))S1
STK086849
ZINC000013894050
ZINC13894050

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Available files

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