3-[6-[4-(3-methoxyphenyl)piperazin-1-yl]-6-oxidanylidene-hexyl]quinazolin-4-one

Systemtic Name: 3-[6-[4-(3-methoxyphenyl)piperazin-1-yl]-6-oxidanylidene-hexyl]quinazolin-4-one Openeye Name: 3-[6-[4-(3-methoxyphenyl)piperazin-1-yl]-6-oxo-hexyl]quinazolin-4-one CAS Name: 3-[6-[4-(3-methoxyphenyl)-1-piperazinyl]-6-oxohexyl]-4-quinazolinone IUPAC Name: 3-[6-[4-(3-methoxyphenyl)piperazin-1-yl]-6-oxohexyl]quinazolin-4-one Traditional Name: 3-[6-keto-6-[4-(3-methoxyphenyl)piperazino]hexyl]quinazolin-4-one Formula: C25H30N4O3 MolecularWeight: 434.5307

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)CCCCCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)CCCCCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C25H30N4O3/c1-32-21-9-7-8-20(18-21)27-14-16-28(17-15-27)24(30)12-3-2-6-13-29-19-26-23-11-5-4-10-22(23)25(29)31/h4-5,7-11,18-19H,2-3,6,12-17H2,1H3