2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-4-pyridin-3-yl-pyridine-3-carbonitrile

Systemtic Name: 2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-4-pyridin-3-yl-pyridine-3-carbonitrile Openeye Name: 2-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-6-phenyl-4-(3-pyridyl)pyridine-3-carbonitrile CAS Name: 2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-6-phenyl-4-(3-pyridinyl)-3-pyridinecarbonitrile IUPAC Name: 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-6-phenyl-4-pyridin-3-ylpyridine-3-carbonitrile Traditional Name: 2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-6-phenyl-4-(3-pyridyl)nicotinonitrile Formula: C25H16ClN3OS MolecularWeight: 441.93204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CN=CC=C3)C#N)SCC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CN=CC=C3)C#N)SCC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H16ClN3OS/c26-20-10-8-18(9-11-20)24(30)16-31-25-22(14-27)21(19-7-4-12-28-15-19)13-23(29-25)17-5-2-1-3-6-17/h1-13,15H,16H2