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

Systemtic Name: methyl 3-chloranyl-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)carbonylsulfamoyl]benzoate Openeye Name: methyl 3-chloro-2-[(5-phenyl-1,3,4-thiadiazole-2-carbonyl)sulfamoyl]benzoate CAS Name: 3-chloro-2-[[oxo-(5-phenyl-1,3,4-thiadiazol-2-yl)methyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 3-chloro-2-[(5-phenyl-1,3,4-thiadiazole-2-carbonyl)sulfamoyl]benzoate Traditional Name: 3-chloro-2-[(5-phenyl-1,3,4-thiadiazole-2-carbonyl)sulfamoyl]benzoic acid methyl ester Formula: C17H12ClN3O5S2 MolecularWeight: 437.87728

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=CC=C1)Cl)S(=O)(=O)NC(=O)C2=NN=C(S2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(C(=CC=C1)Cl)S(=O)(=O)NC(=O)C2=NN=C(S2)C3=CC=CC=C3

InChI

InChI=1S/C17H12ClN3O5S2/c1-26-17(23)11-8-5-9-12(18)13(11)28(24,25)21-14(22)16-20-19-15(27-16)10-6-3-2-4-7-10/h2-9H,1H3,(H,21,22)