Vitas-M small molecule compound
2-[(1,1-dioxido-1,2-benzothiazol-3-yl)(4-methylphenyl)amino]ethyl (2E)-3-(4-methoxyphenyl)prop-2-enoate
Catalog ID
STK180074
SMILES COc1ccc(cc1)/C=C/C(=O)OCCN(C1=NS(=O)(=O)c2c1cccc2)c1ccc(cc1)C
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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 C26H24N2O5S MW 476.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O5S/c1-19-7-12-21(13-8-19)28(26-23-5-3-4-6-24(23)34(30,31)27-26)17-18-33-25(29)16-11-20-9-14-22(32-2)15-10-20/h3-16H,17-18H2,1-2H3/b16-11+InChIKey
PLZZJIMPAVXOHQ-LFIBNONCSA-NSynonyms
2((11DIOXIDO12BENZOTHIAZOL3YL)(4METHYLPHENYL)AMINO)ETHYL(2E)3(4METHOXYPHENYL)PROP2ENOATE
2(N(11DIOXO12BENZOTHIAZOL3YL)4METHYLANILINO)ETHYL(E)3(4METHOXYPHENYL)PROP2ENOATE
CC1=CC=C(C=C1)N(CCOC(=O)C=CC2=CC=C(C=C2)OC)C3=NS(=O)(=O)C4=CC=CC=C43
COc1ccc(cc1)C=CC(=O)OCCN(C1=NS(=O)(=O)c2c1cccc2)c1ccc(cc1)C
InChI=1SC26H24N2O5Sc11971221(13819)28(2623534624(23)34(3031)2726)17183325(29)16112091422(322)151020h316H1718H212H3b1611+
MFCD06760133
ZINC000003642182
ZINC03642182
ZINC3642182
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