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

Systemtic Name: 2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-4-(4-fluorophenyl)-6-thiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxo-ethyl]sulfanyl-4-(4-fluorophenyl)-6-(2-thienyl)pyridine-3-carbonitrile CAS Name: 2-[[2-(3,5-dimethyl-1-pyrazolyl)-2-oxoethyl]thio]-4-(4-fluorophenyl)-6-thiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxoethyl]sulfanyl-4-(4-fluorophenyl)-6-thiophen-2-ylpyridine-3-carbonitrile Traditional Name: 2-[[2-(3,5-dimethylpyrazol-1-yl)-2-keto-ethyl]thio]-4-(4-fluorophenyl)-6-(2-thienyl)nicotinonitrile Formula: C23H17FN4OS2 MolecularWeight: 448.535683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)CSC2=C(C(=CC(=N2)C3=CC=CS3)C4=CC=C(C=C4)F)C#N)C

Isomeric SMILES

CC1=CC(=NN1C(=O)CSC2=C(C(=CC(=N2)C3=CC=CS3)C4=CC=C(C=C4)F)C#N)C

InChI

InChI=1S/C23H17FN4OS2/c1-14-10-15(2)28(27-14)22(29)13-31-23-19(12-25)18(16-5-7-17(24)8-6-16)11-20(26-23)21-4-3-9-30-21/h3-11H,13H2,1-2H3