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

Systemtic Name: N-(2-cyanophenyl)-3-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-propanamide Openeye Name: N-(2-cyanophenyl)-3-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-propanamide CAS Name: N-(2-cyanophenyl)-3-[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]propanamide IUPAC Name: N-(2-cyanophenyl)-3-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylpropanamide Traditional Name: N-(2-cyanophenyl)-3-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]propionamide Formula: C19H18N6OS MolecularWeight: 378.45082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)SCCC(=O)NC3=CC=CC=C3C#N)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)SCCC(=O)NC3=CC=CC=C3C#N)C

InChI

InChI=1S/C19H18N6OS/c1-13-11-14(2)25(24-13)17-7-8-19(23-22-17)27-10-9-18(26)21-16-6-4-3-5-15(16)12-20/h3-8,11H,9-10H2,1-2H3,(H,21,26)