2-[(6-chloranylpyridin-3-yl)methylsulfanyl]-6-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-[(6-chloranylpyridin-3-yl)methylsulfanyl]-6-phenyl-pyridine-3-carbonitrile Openeye Name: 2-[(6-chloro-3-pyridyl)methylsulfanyl]-6-phenyl-pyridine-3-carbonitrile CAS Name: 2-[(6-chloro-3-pyridinyl)methylthio]-6-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-[(6-chloropyridin-3-yl)methylsulfanyl]-6-phenylpyridine-3-carbonitrile Traditional Name: 2-[(6-chloro-3-pyridyl)methylthio]-6-phenyl-nicotinonitrile Formula: C18H12ClN3S MolecularWeight: 337.82598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SCC3=CN=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SCC3=CN=C(C=C3)Cl

InChI

InChI=1S/C18H12ClN3S/c19-17-9-6-13(11-21-17)12-23-18-15(10-20)7-8-16(22-18)14-4-2-1-3-5-14/h1-9,11H,12H2