2-[(3,4-dichlorophenyl)methylsulfanyl]-6-(4-ethoxyphenyl)-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-6-(4-ethoxyphenyl)-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-6-(4-ethoxyphenyl)-4-phenyl-pyridine-3-carbonitrile CAS Name: 2-[(3,4-dichlorophenyl)methylthio]-6-(4-ethoxyphenyl)-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-6-(4-ethoxyphenyl)-4-phenylpyridine-3-carbonitrile Traditional Name: 2-[(3,4-dichlorobenzyl)thio]-4-phenyl-6-p-phenetyl-nicotinonitrile Formula: C27H20Cl2N2OS MolecularWeight: 491.4315

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C27H20Cl2N2OS/c1-2-32-21-11-9-20(10-12-21)26-15-22(19-6-4-3-5-7-19)23(16-30)27(31-26)33-17-18-8-13-24(28)25(29)14-18/h3-15H,2,17H2,1H3