2-[(4-methyl-1,3-benzothiazol-2-yl)carbamoyl]benzenesulfonate

Systemtic Name: 2-[(4-methyl-1,3-benzothiazol-2-yl)carbamoyl]benzenesulfonate Openeye Name: 2-[(4-methyl-1,3-benzothiazol-2-yl)carbamoyl]benzenesulfonate CAS Name: 2-[[(4-methyl-1,3-benzothiazol-2-yl)amino]-oxomethyl]benzenesulfonate IUPAC Name: 2-[(4-methyl-1,3-benzothiazol-2-yl)carbamoyl]benzenesulfonate Traditional Name: 2-[(4-methyl-1,3-benzothiazol-2-yl)carbamoyl]besylate Formula: C15H11N2O4S2- MolecularWeight: 347.38884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC=CC=C3S(=O)(=O)[O-]

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC=CC=C3S(=O)(=O)[O-]

InChI

InChI=1S/C15H12N2O4S2/c1-9-5-4-7-11-13(9)16-15(22-11)17-14(18)10-6-2-3-8-12(10)23(19,20)21/h2-8H,1H3,(H,16,17,18)(H,19,20,21)/p-1