N-(2,3-dimethylphenyl)-2-[6-(2-methoxyphenyl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-[6-(2-methoxyphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(2,3-dimethylphenyl)-2-[6-(2-methoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(2,3-dimethylphenyl)-2-[[6-(2-methoxyphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-[6-(2-methoxyphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(2,3-dimethylphenyl)-2-[[6-(2-methoxyphenyl)pyridazin-3-yl]thio]acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CSC2=NN=C(C=C2)C3=CC=CC=C3OC)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CSC2=NN=C(C=C2)C3=CC=CC=C3OC)C

InChI

InChI=1S/C21H21N3O2S/c1-14-7-6-9-17(15(14)2)22-20(25)13-27-21-12-11-18(23-24-21)16-8-4-5-10-19(16)26-3/h4-12H,13H2,1-3H3,(H,22,25)