4-oxidanylidene-N-[(Z)-(1,3,5-trimethylpyrazol-4-yl)methylideneamino]-3H-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[(Z)-(1,3,5-trimethylpyrazol-4-yl)methylideneamino]-3H-phthalazine-1-carboxamide Openeye Name: 4-oxo-N-[(Z)-(1,3,5-trimethylpyrazol-4-yl)methyleneamino]-3H-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[(Z)-(1,3,5-trimethyl-4-pyrazolyl)methylideneamino]-3H-phthalazine-1-carboxamide IUPAC Name: 4-oxo-N-[(Z)-(1,3,5-trimethylpyrazol-4-yl)methylideneamino]-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[(Z)-(1,3,5-trimethylpyrazol-4-yl)methyleneamino]-3H-phthalazine-1-carboxamide Formula: C16H16N6O2 MolecularWeight: 324.33724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C=NNC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC1=C(C(=NN1C)C)/C=N\NC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C16H16N6O2/c1-9-13(10(2)22(3)21-9)8-17-19-16(24)14-11-6-4-5-7-12(11)15(23)20-18-14/h4-8H,1-3H3,(H,19,24)(H,20,23)/b17-8-