(5-chloranyl-4-methyl-2-sulfamoyl-phenyl) (1Z)-4-methyl-N-(phenylsulfonylamino)benzenecarboximidothioate

Systemtic Name: (5-chloranyl-4-methyl-2-sulfamoyl-phenyl) (1Z)-4-methyl-N-(phenylsulfonylamino)benzenecarboximidothioate Openeye Name: (5-chloro-4-methyl-2-sulfamoyl-phenyl) (1Z)-N-(benzenesulfonamido)-4-methyl-benzenecarboximidothioate CAS Name: (1Z)-N-(benzenesulfonamido)-4-methylbenzenecarboximidothioic acid (5-chloro-4-methyl-2-sulfamoylphenyl) ester IUPAC Name: (5-chloro-4-methyl-2-sulfamoylphenyl) (1Z)-N-(benzenesulfonamido)-4-methylbenzenecarboximidothioate Traditional Name: (1Z)-N-(benzenesulfonamido)-4-methyl-benzenecarboximidothioic acid (5-chloro-4-methyl-2-sulfamoyl-phenyl) ester Formula: C21H20ClN3O4S3 MolecularWeight: 510.0492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=NNS(=O)(=O)C2=CC=CC=C2)SC3=C(C=C(C(=C3)Cl)C)S(=O)(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)/C(=N/NS(=O)(=O)C2=CC=CC=C2)/SC3=C(C=C(C(=C3)Cl)C)S(=O)(=O)N

InChI

InChI=1S/C21H20ClN3O4S3/c1-14-8-10-16(11-9-14)21(24-25-32(28,29)17-6-4-3-5-7-17)30-19-13-18(22)15(2)12-20(19)31(23,26)27/h3-13,25H,1-2H3,(H2,23,26,27)/b24-21-