6-ethyl-8-methyl-2-[4-(phenylmethyl)piperazin-1-yl]pyrido[4,3-d]pyrimidin-5-one

Systemtic Name: 6-ethyl-8-methyl-2-[4-(phenylmethyl)piperazin-1-yl]pyrido[4,3-d]pyrimidin-5-one Openeye Name: 2-(4-benzylpiperazin-1-yl)-6-ethyl-8-methyl-pyrido[4,3-d]pyrimidin-5-one CAS Name: 6-ethyl-8-methyl-2-[4-(phenylmethyl)-1-piperazinyl]-5-pyrido[4,3-d]pyrimidinone IUPAC Name: 2-(4-benzylpiperazin-1-yl)-6-ethyl-8-methylpyrido[4,3-d]pyrimidin-5-one Traditional Name: 2-(4-benzylpiperazino)-6-ethyl-8-methyl-pyrido[4,3-d]pyrimidin-5-one Formula: C21H25N5O MolecularWeight: 363.4561

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=NC(=NC=C2C1=O)N3CCN(CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CCN1C=C(C2=NC(=NC=C2C1=O)N3CCN(CC3)CC4=CC=CC=C4)C

InChI

InChI=1S/C21H25N5O/c1-3-25-14-16(2)19-18(20(25)27)13-22-21(23-19)26-11-9-24(10-12-26)15-17-7-5-4-6-8-17/h4-8,13-14H,3,9-12,15H2,1-2H3