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

Systemtic Name: N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]pentanamide Openeye Name: N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]pentanamide CAS Name: N-[[4-[(2,6-dimethylphenyl)sulfamoyl]anilino]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]pentanamide Traditional Name: N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]thiocarbamoyl]valeramide Formula: C20H25N3O3S2 MolecularWeight: 419.5608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O3S2/c1-4-5-9-18(24)22-20(27)21-16-10-12-17(13-11-16)28(25,26)23-19-14(2)7-6-8-15(19)3/h6-8,10-13,23H,4-5,9H2,1-3H3,(H2,21,22,24,27)