N-[[4-(phenylsulfamoyl)phenyl]carbamothioyl]octanamide

Systemtic Name: N-[[4-(phenylsulfamoyl)phenyl]carbamothioyl]octanamide Openeye Name: N-[[4-(phenylsulfamoyl)phenyl]carbamothioyl]octanamide CAS Name: N-[[4-(phenylsulfamoyl)anilino]-sulfanylidenemethyl]octanamide IUPAC Name: N-[[4-(phenylsulfamoyl)phenyl]carbamothioyl]octanamide Traditional Name: N-[[4-(phenylsulfamoyl)phenyl]thiocarbamoyl]caprylamide Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2

InChI

InChI=1S/C21H27N3O3S2/c1-2-3-4-5-9-12-20(25)23-21(28)22-17-13-15-19(16-14-17)29(26,27)24-18-10-7-6-8-11-18/h6-8,10-11,13-16,24H,2-5,9,12H2,1H3,(H2,22,23,25,28)