3-(4-methylphenyl)-2-morpholin-4-yl-5-[[3-[(3-pyrrolidin-1-ylpropylamino)methyl]phenyl]carbonylamino]pyridine-4-carboxamide

Systemtic Name: 3-(4-methylphenyl)-2-morpholin-4-yl-5-[[3-[(3-pyrrolidin-1-ylpropylamino)methyl]phenyl]carbonylamino]pyridine-4-carboxamide Openeye Name: 2-morpholino-3-(p-tolyl)-5-[[3-[(3-pyrrolidin-1-ylpropylamino)methyl]benzoyl]amino]pyridine-4-carboxamide CAS Name: 3-(4-methylphenyl)-2-(4-morpholinyl)-5-[[oxo-[3-[[3-(1-pyrrolidinyl)propylamino]methyl]phenyl]methyl]amino]-4-pyridinecarboxamide IUPAC Name: 3-(4-methylphenyl)-2-morpholin-4-yl-5-[[3-[(3-pyrrolidin-1-ylpropylamino)methyl]benzoyl]amino]pyridine-4-carboxamide Traditional Name: 2-morpholino-3-(p-tolyl)-5-[[3-[(3-pyrrolidinopropylamino)methyl]benzoyl]amino]isonicotinamide Formula: C32H40N6O3 MolecularWeight: 556.6984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=CN=C2N3CCOCC3)NC(=O)C4=CC(=CC=C4)CNCCCN5CCCC5)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=CN=C2N3CCOCC3)NC(=O)C4=CC(=CC=C4)CNCCCN5CCCC5)C(=O)N

InChI

InChI=1S/C32H40N6O3/c1-23-8-10-25(11-9-23)28-29(30(33)39)27(22-35-31(28)38-16-18-41-19-17-38)36-32(40)26-7-4-6-24(20-26)21-34-12-5-15-37-13-2-3-14-37/h4,6-11,20,22,34H,2-3,5,12-19,21H2,1H3,(H2,33,39)(H,36,40)