ethyl 4-(6-naphthalen-2-yl-4-oxidanylidene-1H-pyrimidin-2-yl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(6-naphthalen-2-yl-4-oxidanylidene-1H-pyrimidin-2-yl)piperazine-1-carboxylate Openeye Name: ethyl 4-[6-(2-naphthyl)-4-oxo-1H-pyrimidin-2-yl]piperazine-1-carboxylate CAS Name: 4-[6-(2-naphthalenyl)-4-oxo-1H-pyrimidin-2-yl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(6-naphthalen-2-yl-4-oxo-1H-pyrimidin-2-yl)piperazine-1-carboxylate Traditional Name: 4-[4-keto-6-(2-naphthyl)-1H-pyrimidin-2-yl]piperazine-1-carboxylic acid ethyl ester Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC(=O)C=C(N2)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC(=O)C=C(N2)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H22N4O3/c1-2-28-21(27)25-11-9-24(10-12-25)20-22-18(14-19(26)23-20)17-8-7-15-5-3-4-6-16(15)13-17/h3-8,13-14H,2,9-12H2,1H3,(H,22,23,26)