Vitas-M small molecule compound
4-{(1E)-2-(acetylamino)-3-[(furan-2-ylmethyl)amino]-3-oxoprop-1-en-1-yl}phenyl 4-methylbenzenesulfonate
Catalog ID
STK554639
SMILES CC(=O)N/C(=C/c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)/C(=O)NCc1ccco1
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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 C23H22N2O6S MW 454.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O6S/c1-16-5-11-21(12-6-16)32(28,29)31-19-9-7-18(8-10-19)14-22(25-17(2)26)23(27)24-15-20-4-3-13-30-20/h3-14H,15H2,1-2H3,(H,24,27)(H,25,26)/b22-14+InChIKey
RDIKYIKNYIBIHU-HYARGMPZSA-NSynonyms
840477-11-4(4((E)2ACETAMIDO3(FURAN2YLMETHYLAMINO)3OXOPROP1ENYL)PHENYL)4METHYLBENZENESULFONATE
(E)4(2acetamido3((furan2ylmethyl)amino)3oxoprop1en1yl)phenyl4methylbenzenesulfonate
4((1E)2(acetylamino)3((furan2ylmethyl)amino)3oxoprop1en1yl)phenyl4methylbenzenesulfonate
840477114
CC(=O)NC(=Cc1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)C(=O)NCc1ccco1
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=C(C(=O)NCC3=CC=CO3)NC(=O)C
InChI=1SC23H22N2O6Sc11651121(12616)32(2829)31199718(81019)1422(2517(2)26)23(27)24152043133020h314H15H212H3(H2427)(H2526)b2214+
MFCD04006054
ZINC000009462829
ZINC09462829
ZINC9462829
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