N-(2-azanylethyl)-4-[cyclohexylmethyl(phenethyl)amino]-1-(4-fluorophenyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-4-[cyclohexylmethyl(phenethyl)amino]-1-(4-fluorophenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-4-[cyclohexylmethyl(phenethyl)amino]-1-(4-fluorobenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-4-[cyclohexylmethyl(phenethyl)amino]-1-[(4-fluorophenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-4-[cyclohexylmethyl(phenethyl)amino]-1-(4-fluorobenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-4-[cyclohexylmethyl(phenethyl)amino]-1-(4-fluorobenzoyl)pyrrolidine-2-carboxamide Formula: C29H39FN4O2 MolecularWeight: 494.643963

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)F)C(=O)NCCN

Isomeric SMILES

C1CCC(CC1)CN(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)F)C(=O)NCCN

InChI

InChI=1S/C29H39FN4O2/c30-25-13-11-24(12-14-25)29(36)34-21-26(19-27(34)28(35)32-17-16-31)33(20-23-9-5-2-6-10-23)18-15-22-7-3-1-4-8-22/h1,3-4,7-8,11-14,23,26-27H,2,5-6,9-10,15-21,31H2,(H,32,35)