(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 2-methyl-5-[(3-methylphenyl)sulfamoyl]benzoate

Systemtic Name: (5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 2-methyl-5-[(3-methylphenyl)sulfamoyl]benzoate Openeye Name: (5-chlorothiadiazol-4-yl)methyl 2-methyl-5-(m-tolylsulfamoyl)benzoate CAS Name: 2-methyl-5-[(3-methylphenyl)sulfamoyl]benzoic acid (5-chloro-4-thiadiazolyl)methyl ester IUPAC Name: (5-chlorothiadiazol-4-yl)methyl 2-methyl-5-[(3-methylphenyl)sulfamoyl]benzoate Traditional Name: 2-methyl-5-(m-tolylsulfamoyl)benzoic acid (5-chlorothiadiazol-4-yl)methyl ester Formula: C18H16ClN3O4S2 MolecularWeight: 437.92034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OCC3=C(SN=N3)Cl

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OCC3=C(SN=N3)Cl

InChI

InChI=1S/C18H16ClN3O4S2/c1-11-4-3-5-13(8-11)21-28(24,25)14-7-6-12(2)15(9-14)18(23)26-10-16-17(19)27-22-20-16/h3-9,21H,10H2,1-2H3