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

Systemtic Name: (2R)-N-(4-azanylcyclohexyl)-4-[phenethyl-(phenylmethyl)amino]-1-thiophen-2-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(4-aminocyclohexyl)-4-[benzyl(phenethyl)amino]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(4-aminocyclohexyl)-1-[oxo(thiophen-2-yl)methyl]-4-[phenethyl-(phenylmethyl)amino]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(4-aminocyclohexyl)-4-[benzyl(phenethyl)amino]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(4-aminocyclohexyl)-4-[benzyl(phenethyl)amino]-1-(2-thenoyl)pipecolinamide Formula: C32H40N4O2S MolecularWeight: 544.7506

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC(=O)C2CC(CCN2C(=O)C3=CC=CS3)N(CCC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CC(CCC1N)NC(=O)[C@H]2CC(CCN2C(=O)C3=CC=CS3)N(CCC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C32H40N4O2S/c33-26-13-15-27(16-14-26)34-31(37)29-22-28(18-20-36(29)32(38)30-12-7-21-39-30)35(23-25-10-5-2-6-11-25)19-17-24-8-3-1-4-9-24/h1-12,21,26-29H,13-20,22-23,33H2,(H,34,37)/t26?,27?,28?,29-/m1/s1