N-(4-isoquinolin-5-yloxyphenyl)-4-[7-(3-methoxypropoxy)quinazolin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-(4-isoquinolin-5-yloxyphenyl)-4-[7-(3-methoxypropoxy)quinazolin-4-yl]piperazine-1-carboxamide Openeye Name: N-[4-(5-isoquinolyloxy)phenyl]-4-[7-(3-methoxypropoxy)quinazolin-4-yl]piperazine-1-carboxamide CAS Name: N-[4-(5-isoquinolinyloxy)phenyl]-4-[7-(3-methoxypropoxy)-4-quinazolinyl]-1-piperazinecarboxamide IUPAC Name: N-(4-isoquinolin-5-yloxyphenyl)-4-[7-(3-methoxypropoxy)quinazolin-4-yl]piperazine-1-carboxamide Traditional Name: N-[4-(5-isoquinolyloxy)phenyl]-4-[7-(3-methoxypropoxy)quinazolin-4-yl]piperazine-1-carboxamide Formula: C32H32N6O4 MolecularWeight: 564.63428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCOC1=CC2=C(C=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC6=C5C=CN=C6

Isomeric SMILES

COCCCOC1=CC2=C(C=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC6=C5C=CN=C6

InChI

InChI=1S/C32H32N6O4/c1-40-18-3-19-41-26-10-11-28-29(20-26)34-22-35-31(28)37-14-16-38(17-15-37)32(39)36-24-6-8-25(9-7-24)42-30-5-2-4-23-21-33-13-12-27(23)30/h2,4-13,20-22H,3,14-19H2,1H3,(H,36,39)