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

Systemtic Name: methyl 4-chloranyl-3-[(4-methyl-1,3-benzothiazol-2-yl)sulfamoyl]benzoate Openeye Name: methyl 4-chloro-3-[(4-methyl-1,3-benzothiazol-2-yl)sulfamoyl]benzoate CAS Name: 4-chloro-3-[(4-methyl-1,3-benzothiazol-2-yl)sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[(4-methyl-1,3-benzothiazol-2-yl)sulfamoyl]benzoate Traditional Name: 4-chloro-3-[(4-methyl-1,3-benzothiazol-2-yl)sulfamoyl]benzoic acid methyl ester Formula: C16H13ClN2O4S2 MolecularWeight: 396.86842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)OC)Cl

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)OC)Cl

InChI

InChI=1S/C16H13ClN2O4S2/c1-9-4-3-5-12-14(9)18-16(24-12)19-25(21,22)13-8-10(15(20)23-2)6-7-11(13)17/h3-8H,1-2H3,(H,18,19)