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

Systemtic Name: [1-(4-methylphenyl)carbonyl-4-[(4-methylphenyl)methyl-phenethyl-amino]pyrrolidin-2-yl]-piperazin-1-yl-methanone Openeye Name: [1-(4-methylbenzoyl)-4-[phenethyl(p-tolylmethyl)amino]pyrrolidin-2-yl]-piperazin-1-yl-methanone CAS Name: [4-[(4-methylphenyl)methyl-phenethylamino]-1-[(4-methylphenyl)-oxomethyl]-2-pyrrolidinyl]-(1-piperazinyl)methanone IUPAC Name: [1-(4-methylbenzoyl)-4-[(4-methylphenyl)methyl-phenethylamino]pyrrolidin-2-yl]-piperazin-1-ylmethanone Traditional Name: [4-[(4-methylbenzyl)-phenethyl-amino]-1-p-toluoyl-pyrrolidin-2-yl]-piperazino-methanone Formula: C33H40N4O2 MolecularWeight: 524.6963

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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)N5CCNCC5

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)N5CCNCC5

InChI

InChI=1S/C33H40N4O2/c1-25-8-12-28(13-9-25)23-36(19-16-27-6-4-3-5-7-27)30-22-31(33(39)35-20-17-34-18-21-35)37(24-30)32(38)29-14-10-26(2)11-15-29/h3-15,30-31,34H,16-24H2,1-2H3