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

Systemtic Name: N-(2-azanylethyl)-4-[cyclopropyl-(phenylmethyl)amino]-1-(4-methylphenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-4-[benzyl(cyclopropyl)amino]-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-4-[cyclopropyl-(phenylmethyl)amino]-1-[(4-methylphenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-4-[benzyl(cyclopropyl)amino]-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-4-[benzyl(cyclopropyl)amino]-1-p-toluoyl-pyrrolidine-2-carboxamide Formula: C25H32N4O2 MolecularWeight: 420.54718

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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)C4CC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)NCCN)N(CC3=CC=CC=C3)C4CC4

InChI

InChI=1S/C25H32N4O2/c1-18-7-9-20(10-8-18)25(31)29-17-22(15-23(29)24(30)27-14-13-26)28(21-11-12-21)16-19-5-3-2-4-6-19/h2-10,21-23H,11-17,26H2,1H3,(H,27,30)