2-[6-(2,5-dimethylphenyl)pyridazin-3-yl]sulfanyl-N-[(3-methoxyphenyl)methyl]ethanamide

Systemtic Name: 2-[6-(2,5-dimethylphenyl)pyridazin-3-yl]sulfanyl-N-[(3-methoxyphenyl)methyl]ethanamide Openeye Name: 2-[6-(2,5-dimethylphenyl)pyridazin-3-yl]sulfanyl-N-[(3-methoxyphenyl)methyl]acetamide CAS Name: 2-[[6-(2,5-dimethylphenyl)-3-pyridazinyl]thio]-N-[(3-methoxyphenyl)methyl]acetamide IUPAC Name: 2-[6-(2,5-dimethylphenyl)pyridazin-3-yl]sulfanyl-N-[(3-methoxyphenyl)methyl]acetamide Traditional Name: 2-[[6-(2,5-dimethylphenyl)pyridazin-3-yl]thio]-N-m-anisyl-acetamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NN=C(C=C2)SCC(=O)NCC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NN=C(C=C2)SCC(=O)NCC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H23N3O2S/c1-15-7-8-16(2)19(11-15)20-9-10-22(25-24-20)28-14-21(26)23-13-17-5-4-6-18(12-17)27-3/h4-12H,13-14H2,1-3H3,(H,23,26)