5-ethanoyl-6-methyl-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carbonitrile

Systemtic Name: 5-ethanoyl-6-methyl-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carbonitrile Openeye Name: 5-acetyl-6-methyl-2-[(5-methylisoxazol-3-yl)methylsulfanyl]pyridine-3-carbonitrile CAS Name: 5-acetyl-6-methyl-2-[(5-methyl-3-isoxazolyl)methylthio]-3-pyridinecarbonitrile IUPAC Name: 5-acetyl-6-methyl-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carbonitrile Traditional Name: 5-acetyl-6-methyl-2-[(5-methylisoxazol-3-yl)methylthio]nicotinonitrile Formula: C14H13N3O2S MolecularWeight: 287.33692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=NC(=C(C=C2C#N)C(=O)C)C

Isomeric SMILES

CC1=CC(=NO1)CSC2=NC(=C(C=C2C#N)C(=O)C)C

InChI

InChI=1S/C14H13N3O2S/c1-8-4-12(17-19-8)7-20-14-11(6-15)5-13(10(3)18)9(2)16-14/h4-5H,7H2,1-3H3