5-ethanoyl-6-methyl-2-propylsulfanyl-pyridine-3-carbonitrile

Systemtic Name: 5-ethanoyl-6-methyl-2-propylsulfanyl-pyridine-3-carbonitrile Openeye Name: 5-acetyl-6-methyl-2-propylsulfanyl-pyridine-3-carbonitrile CAS Name: 5-acetyl-6-methyl-2-(propylthio)-3-pyridinecarbonitrile IUPAC Name: 5-acetyl-6-methyl-2-propylsulfanylpyridine-3-carbonitrile Traditional Name: 5-acetyl-6-methyl-2-(propylthio)nicotinonitrile Formula: C12H14N2OS MolecularWeight: 234.31736

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=C(C=C1C#N)C(=O)C)C

Isomeric SMILES

CCCSC1=NC(=C(C=C1C#N)C(=O)C)C

InChI

InChI=1S/C12H14N2OS/c1-4-5-16-12-10(7-13)6-11(9(3)15)8(2)14-12/h6H,4-5H2,1-3H3