2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-6-ethyl-5-methyl-pyridine-3-carbonitrile

Systemtic Name: 2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-6-ethyl-5-methyl-pyridine-3-carbonitrile Openeye Name: 2-(3,3-dimethyl-2-oxo-butyl)sulfanyl-6-ethyl-5-methyl-pyridine-3-carbonitrile CAS Name: 2-[(3,3-dimethyl-2-oxobutyl)thio]-6-ethyl-5-methyl-3-pyridinecarbonitrile IUPAC Name: 2-(3,3-dimethyl-2-oxobutyl)sulfanyl-6-ethyl-5-methylpyridine-3-carbonitrile Traditional Name: 6-ethyl-2-[(2-keto-3,3-dimethyl-butyl)thio]-5-methyl-nicotinonitrile Formula: C15H20N2OS MolecularWeight: 276.3971

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=N1)SCC(=O)C(C)(C)C)C#N)C

Isomeric SMILES

CCC1=C(C=C(C(=N1)SCC(=O)C(C)(C)C)C#N)C

InChI

InChI=1S/C15H20N2OS/c1-6-12-10(2)7-11(8-16)14(17-12)19-9-13(18)15(3,4)5/h7H,6,9H2,1-5H3