Vitas-M small molecule compound
ethyl 3-{[(3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazol-6-yl)sulfonyl]amino}-3-(4-methylphenyl)propanoate
Catalog ID
STK782880
SMILES CCOC(=O)CC(c1ccc(cc1)C)NS(=O)(=O)c1ccc2c(c1)sc(=O)n2C
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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 C20H22N2O5S2 MW 434.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O5S2/c1-4-27-19(23)12-16(14-7-5-13(2)6-8-14)21-29(25,26)15-9-10-17-18(11-15)28-20(24)22(17)3/h5-11,16,21H,4,12H2,1-3H3InChIKey
ZBIVJWRTTCXTRW-UHFFFAOYSA-NSynonyms
CCOC(=O)CC(C1=CC=C(C=C1)C)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)S3)C
ethyl3(((3methyl2oxo23dihydro13benzothiazol6yl)sulfonyl)amino)3(4methylphenyl)propanoate
ETHYL3((3METHYL2OXO13BENZOTHIAZOL6YL)SULFONYLAMINO)3(4METHYLPHENYL)PROPANOATE
InChI=1SC20H22N2O5S2c142719(23)1216(147513(2)6814)2129(2526)159101718(1115)2820(24)22(17)3h5111621H412H213H3
MFCD06617088
ZINC000012413182
ZINC000012413183
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