(2R)-N-(4-azanylcyclohexyl)-4-[(4-methoxyphenyl)methyl-(2-methylpropyl)amino]-1-pyridin-3-ylcarbonyl-piperidine-2-carboxamide

Systemtic Name: (2R)-N-(4-azanylcyclohexyl)-4-[(4-methoxyphenyl)methyl-(2-methylpropyl)amino]-1-pyridin-3-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(4-aminocyclohexyl)-4-[isobutyl-[(4-methoxyphenyl)methyl]amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(4-aminocyclohexyl)-4-[(4-methoxyphenyl)methyl-(2-methylpropyl)amino]-1-[oxo(3-pyridinyl)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(4-aminocyclohexyl)-4-[(4-methoxyphenyl)methyl-(2-methylpropyl)amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(4-aminocyclohexyl)-4-[isobutyl(p-anisyl)amino]-1-nicotinoyl-pipecolinamide Formula: C30H43N5O3 MolecularWeight: 521.69412

Click to see the large picture

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=CN=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C30H43N5O3/c1-21(2)19-34(20-22-6-12-27(38-3)13-7-22)26-14-16-35(30(37)23-5-4-15-32-18-23)28(17-26)29(36)33-25-10-8-24(31)9-11-25/h4-7,12-13,15,18,21,24-26,28H,8-11,14,16-17,19-20,31H2,1-3H3,(H,33,36)/t24?,25?,26?,28-/m1/s1