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

Systemtic Name: (2R)-N-(4-azanylcyclohexyl)-4-[(4-cyanophenyl)methyl-(2-methoxyethyl)amino]-1-cyclopropylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(4-aminocyclohexyl)-4-[(4-cyanophenyl)methyl-(2-methoxyethyl)amino]-1-(cyclopropanecarbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(4-aminocyclohexyl)-4-[(4-cyanophenyl)methyl-(2-methoxyethyl)amino]-1-[cyclopropyl(oxo)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(4-aminocyclohexyl)-4-[(4-cyanophenyl)methyl-(2-methoxyethyl)amino]-1-(cyclopropanecarbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(4-aminocyclohexyl)-4-[(4-cyanobenzyl)-(2-methoxyethyl)amino]-1-(cyclopropanecarbonyl)pipecolinamide Formula: C27H39N5O3 MolecularWeight: 481.63026

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC=C(C=C1)C#N)C2CCN(C(C2)C(=O)NC3CCC(CC3)N)C(=O)C4CC4

Isomeric SMILES

COCCN(CC1=CC=C(C=C1)C#N)C2CCN([C@H](C2)C(=O)NC3CCC(CC3)N)C(=O)C4CC4

InChI

InChI=1S/C27H39N5O3/c1-35-15-14-31(18-20-4-2-19(17-28)3-5-20)24-12-13-32(27(34)21-6-7-21)25(16-24)26(33)30-23-10-8-22(29)9-11-23/h2-5,21-25H,6-16,18,29H2,1H3,(H,30,33)/t22?,23?,24?,25-/m1/s1