2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-6-(4-methoxyphenyl)-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-6-(4-methoxyphenyl)-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-6-(4-methoxyphenyl)-4-phenyl-pyridine-3-carbonitrile CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]-6-(4-methoxyphenyl)-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]-6-(4-methoxyphenyl)-4-phenyl-nicotinonitrile Formula: C26H18ClFN2OS MolecularWeight: 460.950323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC4=C(C=CC=C4Cl)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C26H18ClFN2OS/c1-31-19-12-10-18(11-13-19)25-14-20(17-6-3-2-4-7-17)21(15-29)26(30-25)32-16-22-23(27)8-5-9-24(22)28/h2-14H,16H2,1H3