4-[[4-[(6-oxidanylidene-1H-pyridazin-3-yl)carbonyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[(6-oxidanylidene-1H-pyridazin-3-yl)carbonyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(6-oxo-1H-pyridazine-3-carbonyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[oxo-(6-oxo-1H-pyridazin-3-yl)methyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(6-oxo-1H-pyridazine-3-carbonyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(6-keto-1H-pyridazine-3-carbonyl)piperazino]methyl]benzonitrile Formula: C17H17N5O2 MolecularWeight: 323.34918

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)C3=NNC(=O)C=C3

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)C3=NNC(=O)C=C3

InChI

InChI=1S/C17H17N5O2/c18-11-13-1-3-14(4-2-13)12-21-7-9-22(10-8-21)17(24)15-5-6-16(23)20-19-15/h1-6H,7-10,12H2,(H,20,23)