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

Systemtic Name: [4-[cyclopropyl-[(4-methylphenyl)methyl]amino]-1-(4-methylphenyl)carbonyl-pyrrolidin-2-yl]-(1,4-diazepan-1-yl)methanone Openeye Name: [4-[cyclopropyl(p-tolylmethyl)amino]-1-(4-methylbenzoyl)pyrrolidin-2-yl]-(1,4-diazepan-1-yl)methanone CAS Name: [4-[cyclopropyl-[(4-methylphenyl)methyl]amino]-1-[(4-methylphenyl)-oxomethyl]-2-pyrrolidinyl]-(1,4-diazepan-1-yl)methanone IUPAC Name: [4-[cyclopropyl-[(4-methylphenyl)methyl]amino]-1-(4-methylbenzoyl)pyrrolidin-2-yl]-(1,4-diazepan-1-yl)methanone Traditional Name: [4-[cyclopropyl-(4-methylbenzyl)amino]-1-p-toluoyl-pyrrolidin-2-yl]-(1,4-diazepan-1-yl)methanone Formula: C29H38N4O2 MolecularWeight: 474.63762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2CC2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)C)C(=O)N5CCCNCC5

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2CC2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)C)C(=O)N5CCCNCC5

InChI

InChI=1S/C29H38N4O2/c1-21-4-8-23(9-5-21)19-32(25-12-13-25)26-18-27(29(35)31-16-3-14-30-15-17-31)33(20-26)28(34)24-10-6-22(2)7-11-24/h4-11,25-27,30H,3,12-20H2,1-2H3