2-(6-cyclohexylsulfonylpyridazin-3-yl)sulfanyl-N-(3,5-dimethoxyphenyl)ethanamide

Systemtic Name: 2-(6-cyclohexylsulfonylpyridazin-3-yl)sulfanyl-N-(3,5-dimethoxyphenyl)ethanamide Openeye Name: 2-(6-cyclohexylsulfonylpyridazin-3-yl)sulfanyl-N-(3,5-dimethoxyphenyl)acetamide CAS Name: 2-[(6-cyclohexylsulfonyl-3-pyridazinyl)thio]-N-(3,5-dimethoxyphenyl)acetamide IUPAC Name: 2-(6-cyclohexylsulfonylpyridazin-3-yl)sulfanyl-N-(3,5-dimethoxyphenyl)acetamide Traditional Name: 2-[(6-cyclohexylsulfonylpyridazin-3-yl)thio]-N-(3,5-dimethoxyphenyl)acetamide Formula: C20H25N3O5S2 MolecularWeight: 451.5596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CSC2=NN=C(C=C2)S(=O)(=O)C3CCCCC3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CSC2=NN=C(C=C2)S(=O)(=O)C3CCCCC3)OC

InChI

InChI=1S/C20H25N3O5S2/c1-27-15-10-14(11-16(12-15)28-2)21-18(24)13-29-19-8-9-20(23-22-19)30(25,26)17-6-4-3-5-7-17/h8-12,17H,3-7,13H2,1-2H3,(H,21,24)