N-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-3-[4-(4-chlorophenyl)piperazin-1-yl]-2-(4-fluoranyl-2-methyl-phenyl)-N-methyl-pyrrolidine-1-carboxamide

Systemtic Name: N-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-3-[4-(4-chlorophenyl)piperazin-1-yl]-2-(4-fluoranyl-2-methyl-phenyl)-N-methyl-pyrrolidine-1-carboxamide Openeye Name: N-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-3-[4-(4-chlorophenyl)piperazin-1-yl]-2-(4-fluoro-2-methyl-phenyl)-N-methyl-pyrrolidine-1-carboxamide CAS Name: N-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-3-[4-(4-chlorophenyl)-1-piperazinyl]-2-(4-fluoro-2-methylphenyl)-N-methyl-1-pyrrolidinecarboxamide IUPAC Name: N-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-3-[4-(4-chlorophenyl)piperazin-1-yl]-2-(4-fluoro-2-methylphenyl)-N-methylpyrrolidine-1-carboxamide Traditional Name: N-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-3-[4-(4-chlorophenyl)piperazino]-2-(4-fluoro-2-methyl-phenyl)-N-methyl-pyrrolidine-1-carboxamide Formula: C33H34ClF7N4O MolecularWeight: 671.091082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)C2C(CCN2C(=O)N(C)C(C)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)N4CCN(CC4)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)F)C2C(CCN2C(=O)N(C)[C@@H](C)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)N4CCN(CC4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C33H34ClF7N4O/c1-20-16-26(35)6-9-28(20)30-29(44-14-12-43(13-15-44)27-7-4-25(34)5-8-27)10-11-45(30)31(46)42(3)21(2)22-17-23(32(36,37)38)19-24(18-22)33(39,40)41/h4-9,16-19,21,29-30H,10-15H2,1-3H3/t21-,29?,30?/m0/s1