N-(4-cyanophenyl)-2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-cyanophenyl)-2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(4-cyanophenyl)-2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(4-cyanophenyl)-2-[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(4-cyanophenyl)-2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(4-cyanophenyl)-2-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]acetamide Formula: C18H16N6OS MolecularWeight: 364.42424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)SCC(=O)NC3=CC=C(C=C3)C#N)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)SCC(=O)NC3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C18H16N6OS/c1-12-9-13(2)24(23-12)16-7-8-18(22-21-16)26-11-17(25)20-15-5-3-14(10-19)4-6-15/h3-9H,11H2,1-2H3,(H,20,25)