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

Systemtic Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[2-methylpropyl-(phenylmethyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[benzyl(isobutyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[2-methylpropyl-(phenylmethyl)amino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[benzyl(2-methylpropyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[benzyl(isobutyl)amino]-1-nicotinoyl-pyrrolidine-2-carboxamide Formula: C30H43N5O2 MolecularWeight: 505.69472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=CC=C1)C2CC(N(C2)C(=O)C3=CN=CC=C3)C(=O)NCC4CCCC(C4)CN

Isomeric SMILES

CC(C)CN(CC1=CC=CC=C1)C2CC(N(C2)C(=O)C3=CN=CC=C3)C(=O)NCC4CCCC(C4)CN

InChI

InChI=1S/C30H43N5O2/c1-22(2)19-34(20-23-8-4-3-5-9-23)27-15-28(35(21-27)30(37)26-12-7-13-32-18-26)29(36)33-17-25-11-6-10-24(14-25)16-31/h3-5,7-9,12-13,18,22,24-25,27-28H,6,10-11,14-17,19-21,31H2,1-2H3,(H,33,36)