methyl 3-(benzo[e][1,3]benzothiazol-2-ylsulfamoyl)thiophene-2-carboxylate

Systemtic Name: methyl 3-(benzo[e][1,3]benzothiazol-2-ylsulfamoyl)thiophene-2-carboxylate Openeye Name: methyl 3-(benzo[e][1,3]benzothiazol-2-ylsulfamoyl)thiophene-2-carboxylate CAS Name: 3-(2-benzo[e][1,3]benzothiazolylsulfamoyl)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-(benzo[e][1,3]benzothiazol-2-ylsulfamoyl)thiophene-2-carboxylate Traditional Name: 3-(benzo[e][1,3]benzothiazol-2-ylsulfamoyl)thiophene-2-carboxylic acid methyl ester Formula: C17H12N2O4S3 MolecularWeight: 404.48318

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43

InChI

InChI=1S/C17H12N2O4S3/c1-23-16(20)15-13(8-9-24-15)26(21,22)19-17-18-14-11-5-3-2-4-10(11)6-7-12(14)25-17/h2-9H,1H3,(H,18,19)