N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]pyrazine-2-carboxamide

Systemtic Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]pyrazine-2-carboxamide Openeye Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]pyrazine-2-carboxamide CAS Name: N-[[4-(3-phenylpropylamino)-2-quinazolinyl]methyl]-2-pyrazinecarboxamide IUPAC Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]pyrazine-2-carboxamide Traditional Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]pyrazinamide Formula: C23H22N6O MolecularWeight: 398.46038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC2=NC(=NC3=CC=CC=C32)CNC(=O)C4=NC=CN=C4

Isomeric SMILES

C1=CC=C(C=C1)CCCNC2=NC(=NC3=CC=CC=C32)CNC(=O)C4=NC=CN=C4

InChI

InChI=1S/C23H22N6O/c30-23(20-15-24-13-14-25-20)27-16-21-28-19-11-5-4-10-18(19)22(29-21)26-12-6-9-17-7-2-1-3-8-17/h1-5,7-8,10-11,13-15H,6,9,12,16H2,(H,27,30)(H,26,28,29)