1-methyl-5-[(4-oxidanylidene-3H-phthalazin-1-yl)methylamino]pyrazole-4-carbonitrile

Systemtic Name: 1-methyl-5-[(4-oxidanylidene-3H-phthalazin-1-yl)methylamino]pyrazole-4-carbonitrile Openeye Name: 1-methyl-5-[(4-oxo-3H-phthalazin-1-yl)methylamino]pyrazole-4-carbonitrile CAS Name: 1-methyl-5-[(4-oxo-3H-phthalazin-1-yl)methylamino]-4-pyrazolecarbonitrile IUPAC Name: 1-methyl-5-[(4-oxo-3H-phthalazin-1-yl)methylamino]pyrazole-4-carbonitrile Traditional Name: 5-[(4-keto-3H-phthalazin-1-yl)methylamino]-1-methyl-pyrazole-4-carbonitrile Formula: C14H12N6O MolecularWeight: 280.28468

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C#N)NCC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CN1C(=C(C=N1)C#N)NCC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C14H12N6O/c1-20-13(9(6-15)7-17-20)16-8-12-10-4-2-3-5-11(10)14(21)19-18-12/h2-5,7,16H,8H2,1H3,(H,19,21)