3-methyl-N-[4-(1-methylimidazol-2-yl)carbonylphenyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-methyl-N-[4-(1-methylimidazol-2-yl)carbonylphenyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-N-[4-(1-methylimidazole-2-carbonyl)phenyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-N-[4-[(1-methyl-2-imidazolyl)-oxomethyl]phenyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-methyl-N-[4-(1-methylimidazole-2-carbonyl)phenyl]-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[4-(1-methylimidazole-2-carbonyl)phenyl]phthalazine-1-carboxamide Formula: C21H17N5O3 MolecularWeight: 387.39138

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(=O)C2=CC=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

Isomeric SMILES

CN1C=CN=C1C(=O)C2=CC=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C21H17N5O3/c1-25-12-11-22-19(25)18(27)13-7-9-14(10-8-13)23-20(28)17-15-5-3-4-6-16(15)21(29)26(2)24-17/h3-12H,1-2H3,(H,23,28)