2-butylsulfanyl-6-methyl-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-butylsulfanyl-6-methyl-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-butylsulfanyl-6-methyl-4-phenyl-pyridine-3-carbonitrile CAS Name: 2-(butylthio)-6-methyl-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-butylsulfanyl-6-methyl-4-phenylpyridine-3-carbonitrile Traditional Name: 2-(butylthio)-6-methyl-4-phenyl-nicotinonitrile Formula: C17H18N2S MolecularWeight: 282.40322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C(C(=CC(=N1)C)C2=CC=CC=C2)C#N

Isomeric SMILES

CCCCSC1=C(C(=CC(=N1)C)C2=CC=CC=C2)C#N

InChI

InChI=1S/C17H18N2S/c1-3-4-10-20-17-16(12-18)15(11-13(2)19-17)14-8-6-5-7-9-14/h5-9,11H,3-4,10H2,1-2H3