(2R)-N-(4-azanylcyclohexyl)-4-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]-1-pyridin-3-ylcarbonyl-piperidine-2-carboxamide

Systemtic Name: (2R)-N-(4-azanylcyclohexyl)-4-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]-1-pyridin-3-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(4-aminocyclohexyl)-4-[benzyl(2-thienylmethyl)amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(4-aminocyclohexyl)-1-[oxo(3-pyridinyl)methyl]-4-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(4-aminocyclohexyl)-4-[benzyl(thiophen-2-ylmethyl)amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(4-aminocyclohexyl)-4-[benzyl(2-thenyl)amino]-1-nicotinoyl-pipecolinamide Formula: C30H37N5O2S MolecularWeight: 531.71208

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC(=O)C2CC(CCN2C(=O)C3=CN=CC=C3)N(CC4=CC=CC=C4)CC5=CC=CS5

Isomeric SMILES

C1CC(CCC1N)NC(=O)[C@H]2CC(CCN2C(=O)C3=CN=CC=C3)N(CC4=CC=CC=C4)CC5=CC=CS5

InChI

InChI=1S/C30H37N5O2S/c31-24-10-12-25(13-11-24)33-29(36)28-18-26(14-16-35(28)30(37)23-8-4-15-32-19-23)34(21-27-9-5-17-38-27)20-22-6-2-1-3-7-22/h1-9,15,17,19,24-26,28H,10-14,16,18,20-21,31H2,(H,33,36)/t24?,25?,26?,28-/m1/s1