Vitas-M small molecule compound
4-{(1E)-2-(acetylamino)-3-oxo-3-[(2-phenylethyl)amino]prop-1-en-1-yl}phenyl 4-methylbenzenesulfonate
Catalog ID
STK554527
SMILES CC(=O)N/C(=C/c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)/C(=O)NCCc1ccccc1
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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 C26H26N2O5S MW 478.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O5S/c1-19-8-14-24(15-9-19)34(31,32)33-23-12-10-22(11-13-23)18-25(28-20(2)29)26(30)27-17-16-21-6-4-3-5-7-21/h3-15,18H,16-17H2,1-2H3,(H,27,30)(H,28,29)/b25-18+InChIKey
BDUYIDOCPZUMHQ-XIEYBQDHSA-NSynonyms
840476-13-3(4((E)2acetamido3oxo3(2phenylethylamino)prop1enyl)phenyl)4methylbenzenesulfonate
(4((E)2ACETAMIDO3OXO3(PHENETHYLAMINO)PROP1ENYL)PHENYL)4METHYLBENZENESULFONATE
(E)4(2acetamido3oxo3(phenethylamino)prop1en1yl)phenyl4methylbenzenesulfonate
4((1E)2(acetylamino)3oxo3((2phenylethyl)amino)prop1en1yl)phenyl4methylbenzenesulfonate
840476133
CC(=O)NC(=Cc1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)C(=O)NCCc1ccccc1
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=C(C(=O)NCCC3=CC=CC=C3)NC(=O)C
InChI=1SC26H26N2O5Sc11981424(15919)34(3132)3323121022(111323)1825(2820(2)29)26(30)271716216435721h31518H1617H212H3(H2730)(H2829)b2518+
MFCD04005875
ZINC000009462673
ZINC09462673
ZINC9462673
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