(2R)-N-(4-azanylcyclohexyl)-4-[(4-methoxyphenyl)methyl-(2-methylpropyl)amino]-1-thiophen-2-ylcarbonyl-piperidine-2-carboxamide

Systemtic Name: (2R)-N-(4-azanylcyclohexyl)-4-[(4-methoxyphenyl)methyl-(2-methylpropyl)amino]-1-thiophen-2-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(4-aminocyclohexyl)-4-[isobutyl-[(4-methoxyphenyl)methyl]amino]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(4-aminocyclohexyl)-4-[(4-methoxyphenyl)methyl-(2-methylpropyl)amino]-1-[oxo(thiophen-2-yl)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(4-aminocyclohexyl)-4-[(4-methoxyphenyl)methyl-(2-methylpropyl)amino]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(4-aminocyclohexyl)-4-[isobutyl(p-anisyl)amino]-1-(2-thenoyl)pipecolinamide Formula: C29H42N4O3S MolecularWeight: 526.73378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=C(C=C1)OC)C2CCN(C(C2)C(=O)NC3CCC(CC3)N)C(=O)C4=CC=CS4

Isomeric SMILES

CC(C)CN(CC1=CC=C(C=C1)OC)C2CCN([C@H](C2)C(=O)NC3CCC(CC3)N)C(=O)C4=CC=CS4

InChI

InChI=1S/C29H42N4O3S/c1-20(2)18-32(19-21-6-12-25(36-3)13-7-21)24-14-15-33(29(35)27-5-4-16-37-27)26(17-24)28(34)31-23-10-8-22(30)9-11-23/h4-7,12-13,16,20,22-24,26H,8-11,14-15,17-19,30H2,1-3H3,(H,31,34)/t22?,23?,24?,26-/m1/s1