N-[[3-(aminomethyl)cyclohexyl]methyl]-1-cyclopropylcarbonyl-4-[2-methylpropyl-(phenylmethyl)amino]pyrrolidine-2-carboxamide

Systemtic Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-1-cyclopropylcarbonyl-4-[2-methylpropyl-(phenylmethyl)amino]pyrrolidine-2-carboxamide Openeye Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[benzyl(isobutyl)amino]-1-(cyclopropanecarbonyl)pyrrolidine-2-carboxamide CAS Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-1-[cyclopropyl(oxo)methyl]-4-[2-methylpropyl-(phenylmethyl)amino]-2-pyrrolidinecarboxamide IUPAC Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[benzyl(2-methylpropyl)amino]-1-(cyclopropanecarbonyl)pyrrolidine-2-carboxamide Traditional Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[benzyl(isobutyl)amino]-1-(cyclopropanecarbonyl)pyrrolidine-2-carboxamide Formula: C28H44N4O2 MolecularWeight: 468.67456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=CC=C1)C2CC(N(C2)C(=O)C3CC3)C(=O)NCC4CCCC(C4)CN

Isomeric SMILES

CC(C)CN(CC1=CC=CC=C1)C2CC(N(C2)C(=O)C3CC3)C(=O)NCC4CCCC(C4)CN

InChI

InChI=1S/C28H44N4O2/c1-20(2)17-31(18-21-7-4-3-5-8-21)25-14-26(32(19-25)28(34)24-11-12-24)27(33)30-16-23-10-6-9-22(13-23)15-29/h3-5,7-8,20,22-26H,6,9-19,29H2,1-2H3,(H,30,33)