methyl 2-(3-cyano-6-propyl-pyridin-2-yl)sulfanyl-2-methyl-propanoate

Systemtic Name: methyl 2-(3-cyano-6-propyl-pyridin-2-yl)sulfanyl-2-methyl-propanoate Openeye Name: methyl 2-[(3-cyano-6-propyl-2-pyridyl)sulfanyl]-2-methyl-propanoate CAS Name: 2-[(3-cyano-6-propyl-2-pyridinyl)thio]-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-(3-cyano-6-propylpyridin-2-yl)sulfanyl-2-methylpropanoate Traditional Name: 2-[(3-cyano-6-propyl-2-pyridyl)thio]-2-methyl-propionic acid methyl ester Formula: C14H18N2O2S MolecularWeight: 278.36992

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(C=C1)C#N)SC(C)(C)C(=O)OC

Isomeric SMILES

CCCC1=NC(=C(C=C1)C#N)SC(C)(C)C(=O)OC

InChI

InChI=1S/C14H18N2O2S/c1-5-6-11-8-7-10(9-15)12(16-11)19-14(2,3)13(17)18-4/h7-8H,5-6H2,1-4H3