4-(6,7-dimethoxyquinazolin-4-yl)-N-[4-(pyridin-4-ylmethyl)phenyl]piperazine-1-carboxamide

Systemtic Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-[4-(pyridin-4-ylmethyl)phenyl]piperazine-1-carboxamide Openeye Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-[4-(4-pyridylmethyl)phenyl]piperazine-1-carboxamide CAS Name: 4-(6,7-dimethoxy-4-quinazolinyl)-N-[4-(pyridin-4-ylmethyl)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-[4-(pyridin-4-ylmethyl)phenyl]piperazine-1-carboxamide Traditional Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-[4-(4-pyridylmethyl)phenyl]piperazine-1-carboxamide Formula: C27H28N6O3 MolecularWeight: 484.54962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)CC5=CC=NC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)CC5=CC=NC=C5)OC

InChI

InChI=1S/C27H28N6O3/c1-35-24-16-22-23(17-25(24)36-2)29-18-30-26(22)32-11-13-33(14-12-32)27(34)31-21-5-3-19(4-6-21)15-20-7-9-28-10-8-20/h3-10,16-18H,11-15H2,1-2H3,(H,31,34)