N-(2-azanylethyl)-4-[(3-methoxyphenyl)methyl-(2-methylpropanoyl)amino]-1-(4-methylphenyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-4-[(3-methoxyphenyl)methyl-(2-methylpropanoyl)amino]-1-(4-methylphenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-4-[(3-methoxyphenyl)methyl-(2-methylpropanoyl)amino]-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-4-[(3-methoxyphenyl)methyl-(2-methyl-1-oxopropyl)amino]-1-[(4-methylphenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-4-[(3-methoxyphenyl)methyl-(2-methylpropanoyl)amino]-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-4-[isobutyryl(m-anisyl)amino]-1-p-toluoyl-pyrrolidine-2-carboxamide Formula: C27H36N4O4 MolecularWeight: 480.59914

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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)OC)C(=O)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C27H36N4O4/c1-18(2)26(33)30(16-20-6-5-7-23(14-20)35-4)22-15-24(25(32)29-13-12-28)31(17-22)27(34)21-10-8-19(3)9-11-21/h5-11,14,18,22,24H,12-13,15-17,28H2,1-4H3,(H,29,32)