2-butylsulfanyl-4-(methoxymethyl)-6-methyl-pyridine-3-carbonitrile

Systemtic Name: 2-butylsulfanyl-4-(methoxymethyl)-6-methyl-pyridine-3-carbonitrile Openeye Name: 2-butylsulfanyl-4-(methoxymethyl)-6-methyl-pyridine-3-carbonitrile CAS Name: 2-(butylthio)-4-(methoxymethyl)-6-methyl-3-pyridinecarbonitrile IUPAC Name: 2-butylsulfanyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile Traditional Name: 2-(butylthio)-4-(methoxymethyl)-6-methyl-nicotinonitrile Formula: C13H18N2OS MolecularWeight: 250.35982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2OS/c1-4-5-6-17-13-12(8-14)11(9-16-3)7-10(2)15-13/h7H,4-6,9H2,1-3H3