1-methylpiperazine; 2-(4-methylpiperazin-1-yl)-4-naphthalen-1-yl-pyrimidine-5-carboxylic acid

Systemtic Name: 1-methylpiperazine; 2-(4-methylpiperazin-1-yl)-4-naphthalen-1-yl-pyrimidine-5-carboxylic acid Openeye Name: 1-methylpiperazine; 2-(4-methylpiperazin-1-yl)-4-(1-naphthyl)pyrimidine-5-carboxylic acid CAS Name: 1-methylpiperazine; 2-(4-methyl-1-piperazinyl)-4-(1-naphthalenyl)-5-pyrimidinecarboxylic acid IUPAC Name: 1-methylpiperazine; 2-(4-methylpiperazin-1-yl)-4-naphthalen-1-ylpyrimidine-5-carboxylic acid Traditional Name: 1-methylpiperazine; 2-(4-methylpiperazino)-4-(1-naphthyl)pyrimidine-5-carboxylic acid Formula: C25H32N6O2 MolecularWeight: 448.56058

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCNCC1.CN1CCN(CC1)C2=NC=C(C(=N2)C3=CC=CC4=CC=CC=C43)C(=O)O

Isomeric SMILES

CN1CCNCC1.CN1CCN(CC1)C2=NC=C(C(=N2)C3=CC=CC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C20H20N4O2.C5H12N2/c1-23-9-11-24(12-10-23)20-21-13-17(19(25)26)18(22-20)16-8-4-6-14-5-2-3-7-15(14)16;1-7-4-2-6-3-5-7/h2-8,13H,9-12H2,1H3,(H,25,26);6H,2-5H2,1H3