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

Systemtic Name: 2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-4-pyridin-4-yl-pyridine-3-carbonitrile Openeye Name: 2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxo-ethyl]sulfanyl-6-methyl-4-(4-pyridyl)pyridine-3-carbonitrile CAS Name: 2-[[2-(3,5-dimethyl-1-pyrazolyl)-2-oxoethyl]thio]-6-methyl-4-pyridin-4-yl-3-pyridinecarbonitrile IUPAC Name: 2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxoethyl]sulfanyl-6-methyl-4-pyridin-4-ylpyridine-3-carbonitrile Traditional Name: 2-[[2-(3,5-dimethylpyrazol-1-yl)-2-keto-ethyl]thio]-6-methyl-4-(4-pyridyl)nicotinonitrile Formula: C19H17N5OS MolecularWeight: 363.43618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)CSC2=C(C(=CC(=N2)C)C3=CC=NC=C3)C#N)C

Isomeric SMILES

CC1=CC(=NN1C(=O)CSC2=C(C(=CC(=N2)C)C3=CC=NC=C3)C#N)C

InChI

InChI=1S/C19H17N5OS/c1-12-9-16(15-4-6-21-7-5-15)17(10-20)19(22-12)26-11-18(25)24-14(3)8-13(2)23-24/h4-9H,11H2,1-3H3