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

Systemtic Name: 2-(4-methoxyphenyl)-2-(6-phenylsulfanylpyridazin-3-yl)ethanenitrile Openeye Name: 2-(4-methoxyphenyl)-2-(6-phenylsulfanylpyridazin-3-yl)acetonitrile CAS Name: 2-(4-methoxyphenyl)-2-[6-(phenylthio)-3-pyridazinyl]acetonitrile IUPAC Name: 2-(4-methoxyphenyl)-2-(6-phenylsulfanylpyridazin-3-yl)acetonitrile Traditional Name: 2-(4-methoxyphenyl)-2-[6-(phenylthio)pyridazin-3-yl]acetonitrile Formula: C19H15N3OS MolecularWeight: 333.4069

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C#N)C2=NN=C(C=C2)SC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(C#N)C2=NN=C(C=C2)SC3=CC=CC=C3

InChI

InChI=1S/C19H15N3OS/c1-23-15-9-7-14(8-10-15)17(13-20)18-11-12-19(22-21-18)24-16-5-3-2-4-6-16/h2-12,17H,1H3