N-(2-azanylethyl)-1-(4-methylphenyl)carbonyl-4-[2-methylpropyl-(phenylmethyl)amino]pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(4-methylphenyl)carbonyl-4-[2-methylpropyl-(phenylmethyl)amino]pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-4-[benzyl(isobutyl)amino]-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(4-methylphenyl)-oxomethyl]-4-[2-methylpropyl-(phenylmethyl)amino]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-4-[benzyl(2-methylpropyl)amino]-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-4-[benzyl(isobutyl)amino]-1-p-toluoyl-pyrrolidine-2-carboxamide Formula: C26H36N4O2 MolecularWeight: 436.58964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)NCCN)N(CC3=CC=CC=C3)CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)NCCN)N(CC3=CC=CC=C3)CC(C)C

InChI

InChI=1S/C26H36N4O2/c1-19(2)16-29(17-21-7-5-4-6-8-21)23-15-24(25(31)28-14-13-27)30(18-23)26(32)22-11-9-20(3)10-12-22/h4-12,19,23-24H,13-18,27H2,1-3H3,(H,28,31)