N-[[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-quinolin-3-yl]methyl]pyridine-2-carboxamide

Systemtic Name: N-[[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-quinolin-3-yl]methyl]pyridine-2-carboxamide Openeye Name: N-[[4-[(3-chloro-4-methoxy-phenyl)methylamino]-6-cyano-3-quinolyl]methyl]pyridine-2-carboxamide CAS Name: N-[[4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-3-quinolinyl]methyl]-2-pyridinecarboxamide IUPAC Name: N-[[4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyanoquinolin-3-yl]methyl]pyridine-2-carboxamide Traditional Name: N-[[4-[(3-chloro-4-methoxy-benzyl)amino]-6-cyano-3-quinolyl]methyl]picolinamide Formula: C25H20ClN5O2 MolecularWeight: 457.9116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=C3C=C(C=CC3=NC=C2CNC(=O)C4=CC=CC=N4)C#N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=C3C=C(C=CC3=NC=C2CNC(=O)C4=CC=CC=N4)C#N)Cl

InChI

InChI=1S/C25H20ClN5O2/c1-33-23-8-6-17(11-20(23)26)13-30-24-18(15-31-25(32)22-4-2-3-9-28-22)14-29-21-7-5-16(12-27)10-19(21)24/h2-11,14H,13,15H2,1H3,(H,29,30)(H,31,32)