N-cyclohexyl-2-[4-(pyridin-3-ylmethylsulfamoyl)phenyl]sulfanyl-ethanamide

Systemtic Name: N-cyclohexyl-2-[4-(pyridin-3-ylmethylsulfamoyl)phenyl]sulfanyl-ethanamide Openeye Name: N-cyclohexyl-2-[4-(3-pyridylmethylsulfamoyl)phenyl]sulfanyl-acetamide CAS Name: N-cyclohexyl-2-[[4-(3-pyridinylmethylsulfamoyl)phenyl]thio]acetamide IUPAC Name: N-cyclohexyl-2-[4-(pyridin-3-ylmethylsulfamoyl)phenyl]sulfanylacetamide Traditional Name: N-cyclohexyl-2-[[4-(3-pyridylmethylsulfamoyl)phenyl]thio]acetamide Formula: C20H25N3O3S2 MolecularWeight: 419.5608

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CSC2=CC=C(C=C2)S(=O)(=O)NCC3=CN=CC=C3

Isomeric SMILES

C1CCC(CC1)NC(=O)CSC2=CC=C(C=C2)S(=O)(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C20H25N3O3S2/c24-20(23-17-6-2-1-3-7-17)15-27-18-8-10-19(11-9-18)28(25,26)22-14-16-5-4-12-21-13-16/h4-5,8-13,17,22H,1-3,6-7,14-15H2,(H,23,24)