5-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-5-yl)-2-piperazin-1-yl-benzenecarbonitrile

Systemtic Name: 5-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-5-yl)-2-piperazin-1-yl-benzenecarbonitrile Openeye Name: 5-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-5-yl)-2-piperazin-1-yl-benzonitrile CAS Name: 5-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-5-yl)-2-(1-piperazinyl)benzonitrile IUPAC Name: 5-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-5-yl)-2-piperazin-1-ylbenzonitrile Traditional Name: 5-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-5-yl)-2-piperazino-benzonitrile Formula: C16H19N5O MolecularWeight: 297.35496

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=NNC(=O)C1C2=CC(=C(C=C2)N3CCNCC3)C#N

Isomeric SMILES

CC1C=NNC(=O)C1C2=CC(=C(C=C2)N3CCNCC3)C#N

InChI

InChI=1S/C16H19N5O/c1-11-10-19-20-16(22)15(11)12-2-3-14(13(8-12)9-17)21-6-4-18-5-7-21/h2-3,8,10-11,15,18H,4-7H2,1H3,(H,20,22)