3-azanyl-5,7,7-trimethyl-2-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]-6,8-dihydro-5H-quinazolin-4-one

Systemtic Name: 3-azanyl-5,7,7-trimethyl-2-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]-6,8-dihydro-5H-quinazolin-4-one Openeye Name: 3-amino-5,7,7-trimethyl-2-[4-[4-(2-quinolyl)piperazin-1-yl]butyl]-6,8-dihydro-5H-quinazolin-4-one CAS Name: 3-amino-5,7,7-trimethyl-2-[4-[4-(2-quinolinyl)-1-piperazinyl]butyl]-6,8-dihydro-5H-quinazolin-4-one IUPAC Name: 3-amino-5,7,7-trimethyl-2-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]-6,8-dihydro-5H-quinazolin-4-one Traditional Name: 3-amino-5,7,7-trimethyl-2-[4-[4-(2-quinolyl)piperazino]butyl]-6,8-dihydro-5H-quinazolin-4-one Formula: C28H38N6O MolecularWeight: 474.64092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC2=C1C(=O)N(C(=N2)CCCCN3CCN(CC3)C4=NC5=CC=CC=C5C=C4)N)(C)C

Isomeric SMILES

CC1CC(CC2=C1C(=O)N(C(=N2)CCCCN3CCN(CC3)C4=NC5=CC=CC=C5C=C4)N)(C)C

InChI

InChI=1S/C28H38N6O/c1-20-18-28(2,3)19-23-26(20)27(35)34(29)25(31-23)10-6-7-13-32-14-16-33(17-15-32)24-12-11-21-8-4-5-9-22(21)30-24/h4-5,8-9,11-12,20H,6-7,10,13-19,29H2,1-3H3