N-(2-azanylethyl)-4-[cyclopropylcarbonyl(phenethyl)amino]-1-(4-methylphenyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-4-[cyclopropylcarbonyl(phenethyl)amino]-1-(4-methylphenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-4-[cyclopropanecarbonyl(phenethyl)amino]-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-4-[[cyclopropyl(oxo)methyl]-phenethylamino]-1-[(4-methylphenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-4-[cyclopropanecarbonyl(phenethyl)amino]-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-4-[cyclopropanecarbonyl(phenethyl)amino]-1-p-toluoyl-pyrrolidine-2-carboxamide Formula: C27H34N4O3 MolecularWeight: 462.58386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)NCCN)N(CCC3=CC=CC=C3)C(=O)C4CC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)NCCN)N(CCC3=CC=CC=C3)C(=O)C4CC4

InChI

InChI=1S/C27H34N4O3/c1-19-7-9-21(10-8-19)27(34)31-18-23(17-24(31)25(32)29-15-14-28)30(26(33)22-11-12-22)16-13-20-5-3-2-4-6-20/h2-10,22-24H,11-18,28H2,1H3,(H,29,32)