2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxo-ethyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[[2-(3,5-dimethyl-1-pyrazolyl)-2-oxoethyl]thio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxoethyl]sulfanyl-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[[2-(3,5-dimethylpyrazol-1-yl)-2-keto-ethyl]thio]-4,6-dimethyl-nicotinonitrile Formula: C15H16N4OS MolecularWeight: 300.37874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(=O)N2C(=CC(=N2)C)C)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC(=O)N2C(=CC(=N2)C)C)C

InChI

InChI=1S/C15H16N4OS/c1-9-5-10(2)17-15(13(9)7-16)21-8-14(20)19-12(4)6-11(3)18-19/h5-6H,8H2,1-4H3