3-methyl-2-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]quinazolin-4-one

Systemtic Name: 3-methyl-2-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]quinazolin-4-one Openeye Name: 3-methyl-2-[4-[4-(2-quinolyl)piperazin-1-yl]butyl]quinazolin-4-one CAS Name: 3-methyl-2-[4-[4-(2-quinolinyl)-1-piperazinyl]butyl]-4-quinazolinone IUPAC Name: 3-methyl-2-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]quinazolin-4-one Traditional Name: 3-methyl-2-[4-[4-(2-quinolyl)piperazino]butyl]quinazolin-4-one Formula: C26H29N5O MolecularWeight: 427.54136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=CC=CC=C2C1=O)CCCCN3CCN(CC3)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CN1C(=NC2=CC=CC=C2C1=O)CCCCN3CCN(CC3)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H29N5O/c1-29-24(28-23-11-5-3-9-21(23)26(29)32)12-6-7-15-30-16-18-31(19-17-30)25-14-13-20-8-2-4-10-22(20)27-25/h2-5,8-11,13-14H,6-7,12,15-19H2,1H3