Vitas-M small molecule compound
methyl 4-({(1E)-3-ethoxy-2-[(4-methylphenyl)sulfonyl]-3-oxoprop-1-en-1-yl}amino)benzoate
Catalog ID
STL133320
SMILES CCOC(=O)/C(=C\Nc1ccc(cc1)C(=O)OC)/S(=O)(=O)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 C20H21NO6S MW 403.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO6S/c1-4-27-20(23)18(28(24,25)17-11-5-14(2)6-12-17)13-21-16-9-7-15(8-10-16)19(22)26-3/h5-13,21H,4H2,1-3H3/b18-13+InChIKey
PQQJCEWXHBKSRJ-QGOAFFKASA-NSynonyms
CCOC(=O)C(=CNC1=CC=C(C=C1)C(=O)OC)S(=O)(=O)C2=CC=C(C=C2)C
CCOC(=O)C(=CNc1ccc(cc1)C(=O)OC)S(=O)(=O)c1ccc(cc1)C
InChI=1SC20H21NO6Sc142720(23)18(28(2425)1711514(2)61217)1321169715(81016)19(22)263h51321H4H213H3b1813+
methyl4(((1E)3ethoxy2((4methylphenyl)sulfonyl)3oxoprop1en1yl)amino)benzoate
methyl4(((E)3ethoxy2(4methylphenyl)sulfonyl3oxoprop1enyl)amino)benzoate
MFCD20753640
ZINC000067340509
ZINC67340509
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