4,5,6-trimethyl-2-(2-methylpropylsulfanyl)pyridine-3-carbonitrile

Systemtic Name: 4,5,6-trimethyl-2-(2-methylpropylsulfanyl)pyridine-3-carbonitrile Openeye Name: 2-isobutylsulfanyl-4,5,6-trimethyl-pyridine-3-carbonitrile CAS Name: 4,5,6-trimethyl-2-(2-methylpropylthio)-3-pyridinecarbonitrile IUPAC Name: 4,5,6-trimethyl-2-(2-methylpropylsulfanyl)pyridine-3-carbonitrile Traditional Name: 2-(isobutylthio)-4,5,6-trimethyl-nicotinonitrile Formula: C13H18N2S MolecularWeight: 234.36042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SCC(C)C)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)SCC(C)C)C

InChI

InChI=1S/C13H18N2S/c1-8(2)7-16-13-12(6-14)10(4)9(3)11(5)15-13/h8H,7H2,1-5H3