2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-5-ethanoyl-6-methyl-pyridine-3-carbonitrile

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-5-ethanoyl-6-methyl-pyridine-3-carbonitrile Openeye Name: 5-acetyl-2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-6-methyl-pyridine-3-carbonitrile CAS Name: 5-acetyl-2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-6-methyl-3-pyridinecarbonitrile IUPAC Name: 5-acetyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-6-methylpyridine-3-carbonitrile Traditional Name: 5-acetyl-2-[(3,5-dimethylisoxazol-4-yl)methylthio]-6-methyl-nicotinonitrile Formula: C15H15N3O2S MolecularWeight: 301.3635

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SCC2=C(ON=C2C)C)C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=N1)SCC2=C(ON=C2C)C)C#N)C(=O)C

InChI

InChI=1S/C15H15N3O2S/c1-8-13(10(3)19)5-12(6-16)15(17-8)21-7-14-9(2)18-20-11(14)4/h5H,7H2,1-4H3