9,10-dimethoxy-2-[4-(phenylmethyl)piperazin-1-yl]-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one

Systemtic Name: 9,10-dimethoxy-2-[4-(phenylmethyl)piperazin-1-yl]-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one Openeye Name: 2-(4-benzylpiperazin-1-yl)-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one CAS Name: 9,10-dimethoxy-2-[4-(phenylmethyl)-1-piperazinyl]-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one IUPAC Name: 2-(4-benzylpiperazin-1-yl)-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one Traditional Name: 2-(4-benzylpiperazino)-9,10-dimethoxy-6,7-dihydropyrimid[6,1-a]isoquinolin-4-one Formula: C25H28N4O3 MolecularWeight: 432.51482

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN3C2=CC(=NC3=O)N4CCN(CC4)CC5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN3C2=CC(=NC3=O)N4CCN(CC4)CC5=CC=CC=C5)OC

InChI

InChI=1S/C25H28N4O3/c1-31-22-14-19-8-9-29-21(20(19)15-23(22)32-2)16-24(26-25(29)30)28-12-10-27(11-13-28)17-18-6-4-3-5-7-18/h3-7,14-16H,8-13,17H2,1-2H3