4-[[1-[(4-chlorophenyl)amino]isoquinolin-4-yl]methyl]-N-methyl-pyridine-2-carboxamide

Systemtic Name: 4-[[1-[(4-chlorophenyl)amino]isoquinolin-4-yl]methyl]-N-methyl-pyridine-2-carboxamide Openeye Name: 4-[[1-(4-chloroanilino)-4-isoquinolyl]methyl]-N-methyl-pyridine-2-carboxamide CAS Name: 4-[[1-(4-chloroanilino)-4-isoquinolinyl]methyl]-N-methyl-2-pyridinecarboxamide IUPAC Name: 4-[[1-(4-chloroanilino)isoquinolin-4-yl]methyl]-N-methylpyridine-2-carboxamide Traditional Name: 4-[[1-(4-chloroanilino)-4-isoquinolyl]methyl]-N-methyl-picolinamide Formula: C23H19ClN4O MolecularWeight: 402.87616

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NC=CC(=C1)CC2=CN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)Cl

Isomeric SMILES

CNC(=O)C1=NC=CC(=C1)CC2=CN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H19ClN4O/c1-25-23(29)21-13-15(10-11-26-21)12-16-14-27-22(20-5-3-2-4-19(16)20)28-18-8-6-17(24)7-9-18/h2-11,13-14H,12H2,1H3,(H,25,29)(H,27,28)