2-phenacylsulfanyl-6-phenyl-4-pyridin-3-yl-pyridine-3-carbonitrile

Systemtic Name: 2-phenacylsulfanyl-6-phenyl-4-pyridin-3-yl-pyridine-3-carbonitrile Openeye Name: 2-phenacylsulfanyl-6-phenyl-4-(3-pyridyl)pyridine-3-carbonitrile CAS Name: 2-(phenacylthio)-6-phenyl-4-(3-pyridinyl)-3-pyridinecarbonitrile IUPAC Name: 2-phenacylsulfanyl-6-phenyl-4-pyridin-3-ylpyridine-3-carbonitrile Traditional Name: 2-(phenacylthio)-6-phenyl-4-(3-pyridyl)nicotinonitrile Formula: C25H17N3OS MolecularWeight: 407.48698

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C25H17N3OS/c26-15-22-21(20-12-7-13-27-16-20)14-23(18-8-3-1-4-9-18)28-25(22)30-17-24(29)19-10-5-2-6-11-19/h1-14,16H,17H2