2-(4-chlorophenyl)-2-(6-phenylsulfanylpyridazin-3-yl)ethanenitrile

Systemtic Name: 2-(4-chlorophenyl)-2-(6-phenylsulfanylpyridazin-3-yl)ethanenitrile Openeye Name: 2-(4-chlorophenyl)-2-(6-phenylsulfanylpyridazin-3-yl)acetonitrile CAS Name: 2-(4-chlorophenyl)-2-[6-(phenylthio)-3-pyridazinyl]acetonitrile IUPAC Name: 2-(4-chlorophenyl)-2-(6-phenylsulfanylpyridazin-3-yl)acetonitrile Traditional Name: 2-(4-chlorophenyl)-2-[6-(phenylthio)pyridazin-3-yl]acetonitrile Formula: C18H12ClN3S MolecularWeight: 337.82598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=NN=C(C=C2)C(C#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)SC2=NN=C(C=C2)C(C#N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H12ClN3S/c19-14-8-6-13(7-9-14)16(12-20)17-10-11-18(22-21-17)23-15-4-2-1-3-5-15/h1-11,16H