[1-(4-methylphenyl)carbonyl-4-[(2-methylphenyl)methyl-(2-methylpropyl)amino]pyrrolidin-2-yl]-piperazin-1-yl-methanone

Systemtic Name: [1-(4-methylphenyl)carbonyl-4-[(2-methylphenyl)methyl-(2-methylpropyl)amino]pyrrolidin-2-yl]-piperazin-1-yl-methanone Openeye Name: [4-[isobutyl(o-tolylmethyl)amino]-1-(4-methylbenzoyl)pyrrolidin-2-yl]-piperazin-1-yl-methanone CAS Name: [4-[(2-methylphenyl)methyl-(2-methylpropyl)amino]-1-[(4-methylphenyl)-oxomethyl]-2-pyrrolidinyl]-(1-piperazinyl)methanone IUPAC Name: [1-(4-methylbenzoyl)-4-[(2-methylphenyl)methyl-(2-methylpropyl)amino]pyrrolidin-2-yl]-piperazin-1-ylmethanone Traditional Name: [4-[isobutyl-(2-methylbenzyl)amino]-1-p-toluoyl-pyrrolidin-2-yl]-piperazino-methanone Formula: C29H40N4O2 MolecularWeight: 476.6535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)N3CCNCC3)N(CC4=CC=CC=C4C)CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)N3CCNCC3)N(CC4=CC=CC=C4C)CC(C)C

InChI

InChI=1S/C29H40N4O2/c1-21(2)18-32(19-25-8-6-5-7-23(25)4)26-17-27(29(35)31-15-13-30-14-16-31)33(20-26)28(34)24-11-9-22(3)10-12-24/h5-12,21,26-27,30H,13-20H2,1-4H3