2-[(3,4-dichlorophenyl)methylsulfanyl]-5-ethanoyl-6-methyl-pyridine-3-carbonitrile

Systemtic Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-5-ethanoyl-6-methyl-pyridine-3-carbonitrile Openeye Name: 5-acetyl-2-[(3,4-dichlorophenyl)methylsulfanyl]-6-methyl-pyridine-3-carbonitrile CAS Name: 5-acetyl-2-[(3,4-dichlorophenyl)methylthio]-6-methyl-3-pyridinecarbonitrile IUPAC Name: 5-acetyl-2-[(3,4-dichlorophenyl)methylsulfanyl]-6-methylpyridine-3-carbonitrile Traditional Name: 5-acetyl-2-[(3,4-dichlorobenzyl)thio]-6-methyl-nicotinonitrile Formula: C16H12Cl2N2OS MolecularWeight: 351.25028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SCC2=CC(=C(C=C2)Cl)Cl)C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=N1)SCC2=CC(=C(C=C2)Cl)Cl)C#N)C(=O)C

InChI

InChI=1S/C16H12Cl2N2OS/c1-9-13(10(2)21)6-12(7-19)16(20-9)22-8-11-3-4-14(17)15(18)5-11/h3-6H,8H2,1-2H3