methyl 3-[[4-(1,3-benzothiazol-2-ylmethyl)phenyl]sulfamoyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[4-(1,3-benzothiazol-2-ylmethyl)phenyl]sulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[[4-(1,3-benzothiazol-2-ylmethyl)phenyl]sulfamoyl]thiophene-2-carboxylate CAS Name: 3-[[4-(1,3-benzothiazol-2-ylmethyl)phenyl]sulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[4-(1,3-benzothiazol-2-ylmethyl)phenyl]sulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[[4-(1,3-benzothiazol-2-ylmethyl)phenyl]sulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C20H16N2O4S3 MolecularWeight: 444.54704

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H16N2O4S3/c1-26-20(23)19-17(10-11-27-19)29(24,25)22-14-8-6-13(7-9-14)12-18-21-15-4-2-3-5-16(15)28-18/h2-11,22H,12H2,1H3