ethyl 4-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)sulfamoyl]benzoate

Systemtic Name: ethyl 4-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)sulfamoyl]benzoate Openeye Name: ethyl 4-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)sulfamoyl]benzoate CAS Name: 4-[[2-(methylthio)-1,3-benzothiazol-6-yl]sulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)sulfamoyl]benzoate Traditional Name: 4-[[2-(methylthio)-1,3-benzothiazol-6-yl]sulfamoyl]benzoic acid ethyl ester Formula: C17H16N2O4S3 MolecularWeight: 408.51494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)N=C(S3)SC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)N=C(S3)SC

InChI

InChI=1S/C17H16N2O4S3/c1-3-23-16(20)11-4-7-13(8-5-11)26(21,22)19-12-6-9-14-15(10-12)25-17(18-14)24-2/h4-10,19H,3H2,1-2H3