2-(tert-butylsulfanylmethoxy)-6-(2-chlorophenyl)-5-(4-chlorophenyl)pyridine-3-carbonitrile

Systemtic Name: 2-(tert-butylsulfanylmethoxy)-6-(2-chlorophenyl)-5-(4-chlorophenyl)pyridine-3-carbonitrile Openeye Name: 2-(tert-butylsulfanylmethoxy)-6-(2-chlorophenyl)-5-(4-chlorophenyl)pyridine-3-carbonitrile CAS Name: 2-[(tert-butylthio)methoxy]-6-(2-chlorophenyl)-5-(4-chlorophenyl)-3-pyridinecarbonitrile IUPAC Name: 2-(tert-butylsulfanylmethoxy)-6-(2-chlorophenyl)-5-(4-chlorophenyl)pyridine-3-carbonitrile Traditional Name: 2-[(tert-butylthio)methoxy]-6-(2-chlorophenyl)-5-(4-chlorophenyl)nicotinonitrile Formula: C23H20Cl2N2OS MolecularWeight: 443.3887

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCOC1=NC(=C(C=C1C#N)C2=CC=C(C=C2)Cl)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)(C)SCOC1=NC(=C(C=C1C#N)C2=CC=C(C=C2)Cl)C3=CC=CC=C3Cl

InChI

InChI=1S/C23H20Cl2N2OS/c1-23(2,3)29-14-28-22-16(13-26)12-19(15-8-10-17(24)11-9-15)21(27-22)18-6-4-5-7-20(18)25/h4-12H,14H2,1-3H3