N-(4-azanylcyclohexyl)-4-[cyclopropylcarbonyl(phenethyl)amino]-1-(4-fluorophenyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-4-[cyclopropylcarbonyl(phenethyl)amino]-1-(4-fluorophenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[cyclopropanecarbonyl(phenethyl)amino]-1-(4-fluorobenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-4-[[cyclopropyl(oxo)methyl]-phenethylamino]-1-[(4-fluorophenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[cyclopropanecarbonyl(phenethyl)amino]-1-(4-fluorobenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[cyclopropanecarbonyl(phenethyl)amino]-1-(4-fluorobenzoyl)pyrrolidine-2-carboxamide Formula: C30H37FN4O3 MolecularWeight: 520.638183

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)F)C(=O)NC5CCC(CC5)N

Isomeric SMILES

C1CC1C(=O)N(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)F)C(=O)NC5CCC(CC5)N

InChI

InChI=1S/C30H37FN4O3/c31-23-10-8-22(9-11-23)30(38)35-19-26(18-27(35)28(36)33-25-14-12-24(32)13-15-25)34(29(37)21-6-7-21)17-16-20-4-2-1-3-5-20/h1-5,8-11,21,24-27H,6-7,12-19,32H2,(H,33,36)