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

Systemtic Name: 2-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]-6-(4-ethoxyphenyl)-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-[(2,6-dichlorophenyl)methylsulfanyl]-6-(4-ethoxyphenyl)-4-phenyl-pyridine-3-carbonitrile CAS Name: 2-[(2,6-dichlorophenyl)methylthio]-6-(4-ethoxyphenyl)-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-[(2,6-dichlorophenyl)methylsulfanyl]-6-(4-ethoxyphenyl)-4-phenylpyridine-3-carbonitrile Traditional Name: 2-[(2,6-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=C(C=CC=C4Cl)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC4=C(C=CC=C4Cl)Cl

InChI

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