6-ethanoyl-2-phenacylsulfanyl-pyridine-3-carbonitrile

Systemtic Name: 6-ethanoyl-2-phenacylsulfanyl-pyridine-3-carbonitrile Openeye Name: 6-acetyl-2-phenacylsulfanyl-pyridine-3-carbonitrile CAS Name: 6-acetyl-2-(phenacylthio)-3-pyridinecarbonitrile IUPAC Name: 6-acetyl-2-phenacylsulfanylpyridine-3-carbonitrile Traditional Name: 6-acetyl-2-(phenacylthio)nicotinonitrile Formula: C16H12N2O2S MolecularWeight: 296.34368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N2O2S/c1-11(19)14-8-7-13(9-17)16(18-14)21-10-15(20)12-5-3-2-4-6-12/h2-8H,10H2,1H3