5-ethanoyl-6-methyl-2-prop-2-enylsulfanyl-pyridine-3-carbonitrile

Systemtic Name: 5-ethanoyl-6-methyl-2-prop-2-enylsulfanyl-pyridine-3-carbonitrile Openeye Name: 5-acetyl-2-allylsulfanyl-6-methyl-pyridine-3-carbonitrile CAS Name: 5-acetyl-6-methyl-2-(prop-2-enylthio)-3-pyridinecarbonitrile IUPAC Name: 5-acetyl-6-methyl-2-prop-2-enylsulfanylpyridine-3-carbonitrile Traditional Name: 5-acetyl-2-(allylthio)-6-methyl-nicotinonitrile Formula: C12H12N2OS MolecularWeight: 232.30148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SCC=C)C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=N1)SCC=C)C#N)C(=O)C

InChI

InChI=1S/C12H12N2OS/c1-4-5-16-12-10(7-13)6-11(9(3)15)8(2)14-12/h4,6H,1,5H2,2-3H3