2-[(3-chlorophenyl)methylsulfanyl]-6-propan-2-yl-pyridine-3-carbonitrile

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-6-propan-2-yl-pyridine-3-carbonitrile Openeye Name: 2-[(3-chlorophenyl)methylsulfanyl]-6-isopropyl-pyridine-3-carbonitrile CAS Name: 2-[(3-chlorophenyl)methylthio]-6-propan-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-[(3-chlorophenyl)methylsulfanyl]-6-propan-2-ylpyridine-3-carbonitrile Traditional Name: 2-[(3-chlorobenzyl)thio]-6-isopropyl-nicotinonitrile Formula: C16H15ClN2S MolecularWeight: 302.8217

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=C(C=C1)C#N)SCC2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)C1=NC(=C(C=C1)C#N)SCC2=CC(=CC=C2)Cl

InChI

InChI=1S/C16H15ClN2S/c1-11(2)15-7-6-13(9-18)16(19-15)20-10-12-4-3-5-14(17)8-12/h3-8,11H,10H2,1-2H3