(2R)-N-(4-azanylcyclohexyl)-1-cyclopropylcarbonyl-4-[cyclopropyl-[(2-methylphenyl)methyl]amino]piperidine-2-carboxamide

Systemtic Name: (2R)-N-(4-azanylcyclohexyl)-1-cyclopropylcarbonyl-4-[cyclopropyl-[(2-methylphenyl)methyl]amino]piperidine-2-carboxamide Openeye Name: (2R)-N-(4-aminocyclohexyl)-1-(cyclopropanecarbonyl)-4-[cyclopropyl(o-tolylmethyl)amino]piperidine-2-carboxamide CAS Name: (2R)-N-(4-aminocyclohexyl)-4-[cyclopropyl-[(2-methylphenyl)methyl]amino]-1-[cyclopropyl(oxo)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(4-aminocyclohexyl)-1-(cyclopropanecarbonyl)-4-[cyclopropyl-[(2-methylphenyl)methyl]amino]piperidine-2-carboxamide Traditional Name: (2R)-N-(4-aminocyclohexyl)-1-(cyclopropanecarbonyl)-4-[cyclopropyl-(2-methylbenzyl)amino]pipecolinamide Formula: C27H40N4O2 MolecularWeight: 452.6321

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(C2CC2)C3CCN(C(C3)C(=O)NC4CCC(CC4)N)C(=O)C5CC5

Isomeric SMILES

CC1=CC=CC=C1CN(C2CC2)C3CCN([C@H](C3)C(=O)NC4CCC(CC4)N)C(=O)C5CC5

InChI

InChI=1S/C27H40N4O2/c1-18-4-2-3-5-20(18)17-31(23-12-13-23)24-14-15-30(27(33)19-6-7-19)25(16-24)26(32)29-22-10-8-21(28)9-11-22/h2-5,19,21-25H,6-17,28H2,1H3,(H,29,32)/t21?,22?,24?,25-/m1/s1