3-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]propyl pyridine-4-carboxylate

Systemtic Name: 3-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]propyl pyridine-4-carboxylate Openeye Name: 3-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]propyl pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid 3-[[2-(4-chlorophenyl)-4-quinazolinyl]amino]propyl ester IUPAC Name: 3-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]propyl pyridine-4-carboxylate Traditional Name: isonicotinic acid 3-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]propyl ester Formula: C23H19ClN4O2 MolecularWeight: 418.87556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=C(C=C3)Cl)NCCCOC(=O)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=C(C=C3)Cl)NCCCOC(=O)C4=CC=NC=C4

InChI

InChI=1S/C23H19ClN4O2/c24-18-8-6-16(7-9-18)21-27-20-5-2-1-4-19(20)22(28-21)26-12-3-15-30-23(29)17-10-13-25-14-11-17/h1-2,4-11,13-14H,3,12,15H2,(H,26,27,28)