Vitas-M small molecule compound
4-[(1E)-2-(acetylamino)-3-oxo-3-(phenylamino)prop-1-en-1-yl]phenyl 4-methylbenzenesulfonate
Catalog ID
STK554410
SMILES CC(=O)N/C(=C/c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)/C(=O)Nc1ccccc1
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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 C24H22N2O5S MW 450.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2O5S/c1-17-8-14-22(15-9-17)32(29,30)31-21-12-10-19(11-13-21)16-23(25-18(2)27)24(28)26-20-6-4-3-5-7-20/h3-16H,1-2H3,(H,25,27)(H,26,28)/b23-16+InChIKey
HBXZLCSQHUZPEB-XQNSMLJCSA-NSynonyms
840473-60-1(4((E)2ACETAMIDO3ANILINO3OXOPROP1ENYL)PHENYL)4METHYLBENZENESULFONATE
(E)4(2acetamido3oxo3(phenylamino)prop1en1yl)phenyl4methylbenzenesulfonate
4((1E)2(acetylamino)3oxo3(phenylamino)prop1en1yl)phenyl4methylbenzenesulfonate
840473601
CC(=O)NC(=Cc1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)C(=O)Nc1ccccc1
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=C(C(=O)NC3=CC=CC=C3)NC(=O)C
InChI=1SC24H22N2O5Sc11781422(15917)32(2930)3121121019(111321)1623(2518(2)27)24(28)26206435720h316H12H3(H2527)(H2628)b2316+
MFCD03634430
ZINC000013750946
ZINC13750946
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