methyl (E)-4-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylbut-2-enoate

Systemtic Name: methyl (E)-4-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylbut-2-enoate Openeye Name: methyl (E)-4-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]but-2-enoate CAS Name: (E)-4-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylbut-2-enoate Traditional Name: (E)-4-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]but-2-enoic acid methyl ester Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC=CC(=O)OC)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SC/C=C/C(=O)OC)C

InChI

InChI=1S/C13H14N2O2S/c1-9-7-10(2)15-13(11(9)8-14)18-6-4-5-12(16)17-3/h4-5,7H,6H2,1-3H3/b5-4+