Vitas-M small molecule compound
4-[(E)-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 2-nitrobenzenesulfonate
Catalog ID
STK032761
SMILES CCN1C(=S)S/C(=C/c2ccc(c(c2)OC)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 C19H16N2O7S3 MW 480.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O7S3/c1-3-20-18(22)16(30-19(20)29)11-12-8-9-14(15(10-12)27-2)28-31(25,26)17-7-5-4-6-13(17)21(23)24/h4-11H,3H2,1-2H3/b16-11+InChIKey
JCSCIXCELUUPFP-LFIBNONCSA-NSynonyms
(4((E)(3ETHYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)2METHOXYPHENYL)2NITROBENZENESULFONATE
4((E)(3ETHYL4OXO2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)2METHOXYPHENYL2NITROBENZENESULFONATE
CCN1C(=O)C(=CC2=CC(=C(C=C2)OS(=O)(=O)C3=CC=CC=C3(N+)(=O)(O))OC)SC1=S
CCN1C(=S)SC(=Cc2ccc(c(c2)OC)OS(=O)(=O)c2ccccc2(N+)(=O)(O))C1=O
InChI=1SC19H16N2O7S3c132018(22)16(3019(20)29)11128914(15(1012)272)2831(2526)17754613(17)21(23)24h411H3H212H3b1611+
MFCD02121475
STK032761
ZINC000006470535
ZINC06470535
ZINC6470535
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Check stock on Vitas-MAvailable files
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