Description:
An impurity of Acotiamide, a drug for the treatment of postprandial fullness, upper abdominal bloating, and early satiation due to functional dyspepsia.
Molecular Formula:
C13H12N2O6S
Canonical SMILES:
CC(=CC1=C(C=C(C=C1)F)F)CN(CC2CCCN2CC3CCC(CC3)N)C(=O)C4=CC(=C(C=C4)OC)OC.CC(=CC1=C(C=C(C=C1)F)F)CN(CC2CCCN2CC3CCC(CC3)NC(=O)OC(C)(C)C)C(=O)C4=CC(=C(C=C4)OC)OC
InChI:
InChI=1S/C36H49F2N3O5.C31H41F2N3O3/c1-24(18-26-11-13-28(37)20-31(26)38)21-41(34(42)27-12-16-32(44-5)33(19-27)45-6)23-30-8-7-17-40(30)22-25-9-14-29(15-10-25)39-35(43)46-36(2,3)4;1-21(15-23-8-10-25(32)17-28(23)33)18-36(31(37)24-9-13-29(38-2)30(16-24)39-3)20-27-5-4-14-35(27)19-22-6-11-26(34)12-7-22/h11-13,16,18-20,25,29-30H,7-10,14-15,17,21-23H2,1-6H3,(H,39,43);8-10,13,15-17,22,26-27H,4-7,11-12,14,18-20,34H2,1-3H3
InChIKey:
YYIROWGLGGSZDH-UHFFFAOYSA-N
Synonyms:
N-[[1-[(4-aminocyclohexyl)methyl]pyrrolidin-2-yl]methyl]-N-[(E)-3-(2,4-difluorophenyl)-2-methylprop-2-enyl]-3,4-dimethoxybenzamide; tert-butyl N-[4-[[2-[[[(E)-3-(2,4-difluorophenyl)-2-methylprop-2-enyl]-(3,4-dimethoxybenzoyl)amino]methyl]pyrrolidin-1-yl]methyl]cyclohexyl]carbamate Más detalles se encuentran
aquí
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