Vitas-M small molecule compound
3-{[(2E)-2-(acetylamino)-3-(4-{[(4-methylphenyl)sulfonyl]oxy}phenyl)prop-2-enoyl]amino}benzoic acid
Catalog ID
STK554466
SMILES CC(=O)N/C(=C/c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)/C(=O)Nc1cccc(c1)C(=O)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 C25H22N2O7S MW 494.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O7S/c1-16-6-12-22(13-7-16)35(32,33)34-21-10-8-18(9-11-21)14-23(26-17(2)28)24(29)27-20-5-3-4-19(15-20)25(30)31/h3-15H,1-2H3,(H,26,28)(H,27,29)(H,30,31)/b23-14+InChIKey
HLXRWBUOXXTWQT-OEAKJJBVSA-NSynonyms
840474-04-6(E)3(2acetamido3(4(tosyloxy)phenyl)acrylamido)benzoicacid
3(((2E)2(acetylamino)3(4(((4methylphenyl)sulfonyl)oxy)phenyl)prop2enoyl)amino)benzoicacid
3(((E)2ACETAMIDO3(4(4METHYLPHENYL)SULFONYLOXYPHENYL)PROP2ENOYL)AMINO)BENZOICACID
840474046
CC(=O)NC(=Cc1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)C(=O)Nc1cccc(c1)C(=O)O
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=C(C(=O)NC3=CC=CC(=C3)C(=O)O)NC(=O)C
InChI=1SC25H22N2O7Sc11661222(13716)35(3233)342110818(91121)1423(2617(2)28)24(29)272053419(1520)25(30)31h315H12H3(H2628)(H2729)(H3031)b2314+
MFCD04005780
ZINC000008914613
ZINC8914613
Check stock
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