2-(4-methylpiperazin-1-yl)-5-oxidanylidene-8-(phenylmethyl)pyrido[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 2-(4-methylpiperazin-1-yl)-5-oxidanylidene-8-(phenylmethyl)pyrido[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 8-benzyl-2-(4-methylpiperazin-1-yl)-5-oxo-pyrido[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 2-(4-methyl-1-piperazinyl)-5-oxo-8-(phenylmethyl)-6-pyrido[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 8-benzyl-2-(4-methylpiperazin-1-yl)-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 8-benzyl-5-keto-2-(4-methylpiperazino)pyrido[2,3-d]pyrimidine-6-carboxylic acid Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C3C(=O)C(=CN(C3=N2)CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C2=NC=C3C(=O)C(=CN(C3=N2)CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C20H21N5O3/c1-23-7-9-24(10-8-23)20-21-11-15-17(26)16(19(27)28)13-25(18(15)22-20)12-14-5-3-2-4-6-14/h2-6,11,13H,7-10,12H2,1H3,(H,27,28)