5-(4-dimethylaminophenyl)-2-oxidanylidene-N-[4-(pyridin-3-ylmethylamino)cyclohexyl]-1H-pyridine-3-carboxamide

Systemtic Name: 5-(4-dimethylaminophenyl)-2-oxidanylidene-N-[4-(pyridin-3-ylmethylamino)cyclohexyl]-1H-pyridine-3-carboxamide Openeye Name: 5-(4-dimethylaminophenyl)-2-oxo-N-[4-(3-pyridylmethylamino)cyclohexyl]-1H-pyridine-3-carboxamide CAS Name: 5-(4-dimethylaminophenyl)-2-oxo-N-[4-(3-pyridinylmethylamino)cyclohexyl]-1H-pyridine-3-carboxamide IUPAC Name: 5-(4-dimethylaminophenyl)-2-oxo-N-[4-(pyridin-3-ylmethylamino)cyclohexyl]-1H-pyridine-3-carboxamide Traditional Name: 5-(4-dimethylaminophenyl)-2-keto-N-[4-(3-pyridylmethylamino)cyclohexyl]-1H-pyridine-3-carboxamide Formula: C26H31N5O2 MolecularWeight: 445.55664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=CNC(=O)C(=C2)C(=O)NC3CCC(CC3)NCC4=CN=CC=C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=CNC(=O)C(=C2)C(=O)NC3CCC(CC3)NCC4=CN=CC=C4

InChI

InChI=1S/C26H31N5O2/c1-31(2)23-11-5-19(6-12-23)20-14-24(25(32)29-17-20)26(33)30-22-9-7-21(8-10-22)28-16-18-4-3-13-27-15-18/h3-6,11-15,17,21-22,28H,7-10,16H2,1-2H3,(H,29,32)(H,30,33)