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methyl 4-[(6-sulfamoyl-1,3-benzothiazol-2-yl)carbamoyl]benzoate

methyl 4-[(6-sulfamoyl-1,3-benzothiazol-2-yl)carbamoyl]benzoate

Systemtic Name:methyl 4-[(6-sulfamoyl-1,3-benzothiazol-2-yl)carbamoyl]benzoate
Openeye Name:methyl 4-[(6-sulfamoyl-1,3-benzothiazol-2-yl)carbamoyl]benzoate
CAS Name:4-[oxo-[(6-sulfamoyl-1,3-benzothiazol-2-yl)amino]methyl]benzoic acid methyl ester
IUPAC Name:methyl 4-[(6-sulfamoyl-1,3-benzothiazol-2-yl)carbamoyl]benzoate
Traditional Name:4-[(6-sulfamoyl-1,3-benzothiazol-2-yl)carbamoyl]benzoic acid methyl ester
Formula: C16H13N3O5S2
MolecularWeight: 391.42152
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)N


Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)N


InChI

InChI=1S/C16H13N3O5S2/c1-24-15(21)10-4-2-9(3-5-10)14(20)19-16-18-12-7-6-11(26(17,22)23)8-13(12)25-16/h2-8H,1H3,(H2,17,22,23)(H,18,19,20)


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