N-[3-(dimethylsulfamoyl)phenyl]azepane-1-carbothioamide

Systemtic Name: N-[3-(dimethylsulfamoyl)phenyl]azepane-1-carbothioamide Openeye Name: N-[3-(dimethylsulfamoyl)phenyl]azepane-1-carbothioamide CAS Name: N-[3-(dimethylsulfamoyl)phenyl]-1-azepanecarbothioamide IUPAC Name: N-[3-(dimethylsulfamoyl)phenyl]azepane-1-carbothioamide Traditional Name: N-[3-(dimethylsulfamoyl)phenyl]azepane-1-carbothioamide Formula: C15H23N3O2S2 MolecularWeight: 341.49202

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=S)N2CCCCCC2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=S)N2CCCCCC2

InChI

InChI=1S/C15H23N3O2S2/c1-17(2)22(19,20)14-9-7-8-13(12-14)16-15(21)18-10-5-3-4-6-11-18/h7-9,12H,3-6,10-11H2,1-2H3,(H,16,21)