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

Systemtic Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[cyclopropylcarbonyl(2-methylpropyl)amino]-1-ethanoyl-pyrrolidine-2-carboxamide Openeye Name: 1-acetyl-N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[cyclopropanecarbonyl(isobutyl)amino]pyrrolidine-2-carboxamide CAS Name: 1-acetyl-N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[[cyclopropyl(oxo)methyl]-(2-methylpropyl)amino]-2-pyrrolidinecarboxamide IUPAC Name: 1-acetyl-N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[cyclopropanecarbonyl(2-methylpropyl)amino]pyrrolidine-2-carboxamide Traditional Name: 1-acetyl-N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[cyclopropanecarbonyl(isobutyl)amino]pyrrolidine-2-carboxamide Formula: C23H40N4O3 MolecularWeight: 420.5887

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C1CC(N(C1)C(=O)C)C(=O)NCC2CCCC(C2)CN)C(=O)C3CC3

Isomeric SMILES

CC(C)CN(C1CC(N(C1)C(=O)C)C(=O)NCC2CCCC(C2)CN)C(=O)C3CC3

InChI

InChI=1S/C23H40N4O3/c1-15(2)13-27(23(30)19-7-8-19)20-10-21(26(14-20)16(3)28)22(29)25-12-18-6-4-5-17(9-18)11-24/h15,17-21H,4-14,24H2,1-3H3,(H,25,29)