methyl 2-[[2-[(4-methylphenyl)sulfonylamino]phenyl]carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-[[2-[(4-methylphenyl)sulfonylamino]phenyl]carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[[2-(p-tolylsulfonylamino)benzoyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[[2-[(4-methylphenyl)sulfonylamino]phenyl]-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[2-(tosylamino)benzoyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C23H19N3O5S2 MolecularWeight: 481.54406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)NC3=NC4=C(S3)C=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)NC3=NC4=C(S3)C=C(C=C4)C(=O)OC

InChI

InChI=1S/C23H19N3O5S2/c1-14-7-10-16(11-8-14)33(29,30)26-18-6-4-3-5-17(18)21(27)25-23-24-19-12-9-15(22(28)31-2)13-20(19)32-23/h3-13,26H,1-2H3,(H,24,25,27)