2-(6-cyclohexylsulfonylpyridazin-3-yl)sulfanyl-N-[(4-methoxyphenyl)methyl]ethanamide

Systemtic Name: 2-(6-cyclohexylsulfonylpyridazin-3-yl)sulfanyl-N-[(4-methoxyphenyl)methyl]ethanamide Openeye Name: 2-(6-cyclohexylsulfonylpyridazin-3-yl)sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide CAS Name: 2-[(6-cyclohexylsulfonyl-3-pyridazinyl)thio]-N-[(4-methoxyphenyl)methyl]acetamide IUPAC Name: 2-(6-cyclohexylsulfonylpyridazin-3-yl)sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide Traditional Name: 2-[(6-cyclohexylsulfonylpyridazin-3-yl)thio]-N-p-anisyl-acetamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O4S2/c1-27-16-9-7-15(8-10-16)13-21-18(24)14-28-19-11-12-20(23-22-19)29(25,26)17-5-3-2-4-6-17/h7-12,17H,2-6,13-14H2,1H3,(H,21,24)