ethyl 6-ethyl-5-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]pyrido[4,3-d]pyrimidine-7-carboxylate

Systemtic Name: ethyl 6-ethyl-5-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]pyrido[4,3-d]pyrimidine-7-carboxylate Openeye Name: ethyl 2-(4-benzylpiperazin-1-yl)-6-ethyl-5-oxo-pyrido[4,3-d]pyrimidine-7-carboxylate CAS Name: 6-ethyl-5-oxo-2-[4-(phenylmethyl)-1-piperazinyl]-7-pyrido[4,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-benzylpiperazin-1-yl)-6-ethyl-5-oxopyrido[4,3-d]pyrimidine-7-carboxylate Traditional Name: 2-(4-benzylpiperazino)-6-ethyl-5-keto-pyrido[4,3-d]pyrimidine-7-carboxylic acid ethyl ester Formula: C23H27N5O3 MolecularWeight: 421.49218

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=NC(=NC=C2C1=O)N3CCN(CC3)CC4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCN1C(=CC2=NC(=NC=C2C1=O)N3CCN(CC3)CC4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C23H27N5O3/c1-3-28-20(22(30)31-4-2)14-19-18(21(28)29)15-24-23(25-19)27-12-10-26(11-13-27)16-17-8-6-5-7-9-17/h5-9,14-15H,3-4,10-13,16H2,1-2H3