6-ethyl-5-oxidanylidene-2-(4-phenylmethoxypiperazin-1-yl)pyrido[4,3-d]pyrimidine-8-carbonitrile

Systemtic Name: 6-ethyl-5-oxidanylidene-2-(4-phenylmethoxypiperazin-1-yl)pyrido[4,3-d]pyrimidine-8-carbonitrile Openeye Name: 2-(4-benzyloxypiperazin-1-yl)-6-ethyl-5-oxo-pyrido[4,3-d]pyrimidine-8-carbonitrile CAS Name: 6-ethyl-5-oxo-2-(4-phenylmethoxy-1-piperazinyl)-8-pyrido[4,3-d]pyrimidinecarbonitrile IUPAC Name: 6-ethyl-5-oxo-2-(4-phenylmethoxypiperazin-1-yl)pyrido[4,3-d]pyrimidine-8-carbonitrile Traditional Name: 2-(4-benzoxypiperazino)-6-ethyl-5-keto-pyrido[4,3-d]pyrimidine-8-carbonitrile Formula: C21H22N6O2 MolecularWeight: 390.43838

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=NC(=NC=C2C1=O)N3CCN(CC3)OCC4=CC=CC=C4)C#N

Isomeric SMILES

CCN1C=C(C2=NC(=NC=C2C1=O)N3CCN(CC3)OCC4=CC=CC=C4)C#N

InChI

InChI=1S/C21H22N6O2/c1-2-25-14-17(12-22)19-18(20(25)28)13-23-21(24-19)26-8-10-27(11-9-26)29-15-16-6-4-3-5-7-16/h3-7,13-14H,2,8-11,15H2,1H3