N-(4-azanylcyclohexyl)-4-[(4-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-4-[(4-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[2-morpholinoethyl(p-tolylmethyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-4-[(4-methylphenyl)methyl-[2-(4-morpholinyl)ethyl]amino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[(4-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[(4-methylbenzyl)-(2-morpholinoethyl)amino]-1-nicotinoyl-pyrrolidine-2-carboxamide Formula: C31H44N6O3 MolecularWeight: 548.71946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CCN2CCOCC2)C3CC(N(C3)C(=O)C4=CN=CC=C4)C(=O)NC5CCC(CC5)N

Isomeric SMILES

CC1=CC=C(C=C1)CN(CCN2CCOCC2)C3CC(N(C3)C(=O)C4=CN=CC=C4)C(=O)NC5CCC(CC5)N

InChI

InChI=1S/C31H44N6O3/c1-23-4-6-24(7-5-23)21-36(14-13-35-15-17-40-18-16-35)28-19-29(30(38)34-27-10-8-26(32)9-11-27)37(22-28)31(39)25-3-2-12-33-20-25/h2-7,12,20,26-29H,8-11,13-19,21-22,32H2,1H3,(H,34,38)