1,4-diazepan-1-yl-[1-(4-methylphenyl)carbonyl-4-[(4-methylphenyl)methyl-phenethyl-amino]pyrrolidin-2-yl]methanone

Systemtic Name: 1,4-diazepan-1-yl-[1-(4-methylphenyl)carbonyl-4-[(4-methylphenyl)methyl-phenethyl-amino]pyrrolidin-2-yl]methanone Openeye Name: 1,4-diazepan-1-yl-[1-(4-methylbenzoyl)-4-[phenethyl(p-tolylmethyl)amino]pyrrolidin-2-yl]methanone CAS Name: 1,4-diazepan-1-yl-[4-[(4-methylphenyl)methyl-phenethylamino]-1-[(4-methylphenyl)-oxomethyl]-2-pyrrolidinyl]methanone IUPAC Name: 1,4-diazepan-1-yl-[1-(4-methylbenzoyl)-4-[(4-methylphenyl)methyl-phenethylamino]pyrrolidin-2-yl]methanone Traditional Name: 1,4-diazepan-1-yl-[4-[(4-methylbenzyl)-phenethyl-amino]-1-p-toluoyl-pyrrolidin-2-yl]methanone Formula: C34H42N4O2 MolecularWeight: 538.72288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)C)C(=O)N5CCCNCC5

Isomeric SMILES

CC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)C)C(=O)N5CCCNCC5

InChI

InChI=1S/C34H42N4O2/c1-26-9-13-29(14-10-26)24-37(21-17-28-7-4-3-5-8-28)31-23-32(34(40)36-20-6-18-35-19-22-36)38(25-31)33(39)30-15-11-27(2)12-16-30/h3-5,7-16,31-32,35H,6,17-25H2,1-2H3