N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]octanamide

Systemtic Name: N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]octanamide Openeye Name: N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]octanamide CAS Name: N-[[4-[(2,6-dimethylphenyl)sulfamoyl]anilino]-sulfanylidenemethyl]octanamide IUPAC Name: N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]octanamide Traditional Name: N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]thiocarbamoyl]caprylamide Formula: C23H31N3O3S2 MolecularWeight: 461.64054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC=C2C)C

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC=C2C)C

InChI

InChI=1S/C23H31N3O3S2/c1-4-5-6-7-8-12-21(27)25-23(30)24-19-13-15-20(16-14-19)31(28,29)26-22-17(2)10-9-11-18(22)3/h9-11,13-16,26H,4-8,12H2,1-3H3,(H2,24,25,27,30)