N-(4-azanylcyclohexyl)-4-[cyclopropyl-(4-methoxyphenyl)carbonyl-amino]-1-(4-fluorophenyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-4-[cyclopropyl-(4-methoxyphenyl)carbonyl-amino]-1-(4-fluorophenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[cyclopropyl-(4-methoxybenzoyl)amino]-1-(4-fluorobenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-4-[cyclopropyl-[(4-methoxyphenyl)-oxomethyl]amino]-1-[(4-fluorophenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[cyclopropyl-(4-methoxybenzoyl)amino]-1-(4-fluorobenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[cyclopropyl(p-anisoyl)amino]-1-(4-fluorobenzoyl)pyrrolidine-2-carboxamide Formula: C29H35FN4O4 MolecularWeight: 522.611003

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N(C2CC2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)F)C(=O)NC5CCC(CC5)N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N(C2CC2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)F)C(=O)NC5CCC(CC5)N

InChI

InChI=1S/C29H35FN4O4/c1-38-25-14-4-19(5-15-25)29(37)34(23-12-13-23)24-16-26(27(35)32-22-10-8-21(31)9-11-22)33(17-24)28(36)18-2-6-20(30)7-3-18/h2-7,14-15,21-24,26H,8-13,16-17,31H2,1H3,(H,32,35)