2-(4-chlorophenyl)-2-[6-(4-phenylpiperazin-1-yl)pyridazin-3-yl]ethanenitrile

Systemtic Name: 2-(4-chlorophenyl)-2-[6-(4-phenylpiperazin-1-yl)pyridazin-3-yl]ethanenitrile Openeye Name: 2-(4-chlorophenyl)-2-[6-(4-phenylpiperazin-1-yl)pyridazin-3-yl]acetonitrile CAS Name: 2-(4-chlorophenyl)-2-[6-(4-phenyl-1-piperazinyl)-3-pyridazinyl]acetonitrile IUPAC Name: 2-(4-chlorophenyl)-2-[6-(4-phenylpiperazin-1-yl)pyridazin-3-yl]acetonitrile Traditional Name: 2-(4-chlorophenyl)-2-[6-(4-phenylpiperazino)pyridazin-3-yl]acetonitrile Formula: C22H20ClN5 MolecularWeight: 389.8807

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=NN=C(C=C3)C(C#N)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=NN=C(C=C3)C(C#N)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H20ClN5/c23-18-8-6-17(7-9-18)20(16-24)21-10-11-22(26-25-21)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20H,12-15H2