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

Systemtic Name: N-(4-azanylcyclohexyl)-4-[3,3-dimethylbutanoyl(2-morpholin-4-ylethyl)amino]-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[3,3-dimethylbutanoyl(2-morpholinoethyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-4-[(3,3-dimethyl-1-oxobutyl)-[2-(4-morpholinyl)ethyl]amino]-1-[oxo(3-pyridinyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[3,3-dimethylbutanoyl(2-morpholin-4-ylethyl)amino]-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[3,3-dimethylbutanoyl(2-morpholinoethyl)amino]-1-nicotinoyl-pyrrolidine-2-carboxamide Formula: C29H46N6O4 MolecularWeight: 542.71334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N(CCN1CCOCC1)C2CC(N(C2)C(=O)C3=CN=CC=C3)C(=O)NC4CCC(CC4)N

Isomeric SMILES

CC(C)(C)CC(=O)N(CCN1CCOCC1)C2CC(N(C2)C(=O)C3=CN=CC=C3)C(=O)NC4CCC(CC4)N

InChI

InChI=1S/C29H46N6O4/c1-29(2,3)18-26(36)34(12-11-33-13-15-39-16-14-33)24-17-25(27(37)32-23-8-6-22(30)7-9-23)35(20-24)28(38)21-5-4-10-31-19-21/h4-5,10,19,22-25H,6-9,11-18,20,30H2,1-3H3,(H,32,37)