5,7-dimethyl-3-(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)pyrimido[4,5-e][1,2,4]triazine-6,8-dione

Systemtic Name: 5,7-dimethyl-3-(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)pyrimido[4,5-e][1,2,4]triazine-6,8-dione Openeye Name: 5,7-dimethyl-3-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)pyrimido[4,5-e][1,2,4]triazine-6,8-dione CAS Name: 5,7-dimethyl-3-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)pyrimido[4,5-e][1,2,4]triazine-6,8-dione IUPAC Name: 5,7-dimethyl-3-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)pyrimido[4,5-e][1,2,4]triazine-6,8-dione Traditional Name: 3-(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)-5,7-dimethyl-pyrimido[4,5-e][1,2,4]triazine-6,8-quinone Formula: C17H15N7O3 MolecularWeight: 365.3461

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C3=NC4=C(C(=O)N(C(=O)N4C)C)N=N3

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C3=NC4=C(C(=O)N(C(=O)N4C)C)N=N3

InChI

InChI=1S/C17H15N7O3/c1-9-11(15(25)24(21-9)10-7-5-4-6-8-10)13-18-14-12(19-20-13)16(26)23(3)17(27)22(14)2/h4-8,21H,1-3H3