2-[5-methyl-3-oxidanylidene-4-(phenylmethyl)-1H-pyrazol-2-yl]-6-oxidanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: 2-[5-methyl-3-oxidanylidene-4-(phenylmethyl)-1H-pyrazol-2-yl]-6-oxidanylidene-1H-pyrimidine-5-carboxylate Openeye Name: 2-(4-benzyl-5-methyl-3-oxo-1H-pyrazol-2-yl)-6-oxo-1H-pyrimidine-5-carboxylate CAS Name: 2-[5-methyl-3-oxo-4-(phenylmethyl)-1H-pyrazol-2-yl]-6-oxo-1H-pyrimidine-5-carboxylate IUPAC Name: 2-(4-benzyl-5-methyl-3-oxo-1H-pyrazol-2-yl)-6-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 2-(4-benzyl-5-keto-3-methyl-3-pyrazolin-1-yl)-6-keto-1H-pyrimidine-5-carboxylate Formula: C16H13N4O4- MolecularWeight: 325.29882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=NC=C(C(=O)N2)C(=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=NC=C(C(=O)N2)C(=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C16H14N4O4/c1-9-11(7-10-5-3-2-4-6-10)14(22)20(19-9)16-17-8-12(15(23)24)13(21)18-16/h2-6,8,19H,7H2,1H3,(H,23,24)(H,17,18,21)/p-1