2-[(4-chlorophenyl)-cyano-methyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-[(4-chlorophenyl)-cyano-methyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 2-[(4-chlorophenyl)-cyano-methyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[[(4-chlorophenyl)-cyanomethyl]thio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[(4-chlorophenyl)-cyanomethyl]sulfanyl-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[[(4-chlorophenyl)-cyano-methyl]thio]-4,6-dimethyl-nicotinonitrile Formula: C16H12ClN3S MolecularWeight: 313.80458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SC(C#N)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SC(C#N)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C16H12ClN3S/c1-10-7-11(2)20-16(14(10)8-18)21-15(9-19)12-3-5-13(17)6-4-12/h3-7,15H,1-2H3