(2R)-N-(4-azanylcyclohexyl)-1-cyclopropylcarbonyl-4-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]piperidine-2-carboxamide

Systemtic Name: (2R)-N-(4-azanylcyclohexyl)-1-cyclopropylcarbonyl-4-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]piperidine-2-carboxamide Openeye Name: (2R)-N-(4-aminocyclohexyl)-4-[benzyl(2-thienylmethyl)amino]-1-(cyclopropanecarbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(4-aminocyclohexyl)-1-[cyclopropyl(oxo)methyl]-4-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(4-aminocyclohexyl)-4-[benzyl(thiophen-2-ylmethyl)amino]-1-(cyclopropanecarbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(4-aminocyclohexyl)-4-[benzyl(2-thenyl)amino]-1-(cyclopropanecarbonyl)pipecolinamide Formula: C28H38N4O2S MolecularWeight: 494.69192

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCC(CC2C(=O)NC3CCC(CC3)N)N(CC4=CC=CC=C4)CC5=CC=CS5

Isomeric SMILES

C1CC1C(=O)N2CCC(C[C@@H]2C(=O)NC3CCC(CC3)N)N(CC4=CC=CC=C4)CC5=CC=CS5

InChI

InChI=1S/C28H38N4O2S/c29-22-10-12-23(13-11-22)30-27(33)26-17-24(14-15-32(26)28(34)21-8-9-21)31(19-25-7-4-16-35-25)18-20-5-2-1-3-6-20/h1-7,16,21-24,26H,8-15,17-19,29H2,(H,30,33)/t22?,23?,24?,26-/m1/s1