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

Systemtic Name: methyl 2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-(p-tolylsulfonylamino)-1,3-benzothiazole-6-carboxylate CAS Name: 2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(tosylamino)-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C16H14N2O4S2 MolecularWeight: 362.42336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C16H14N2O4S2/c1-10-3-6-12(7-4-10)24(20,21)18-16-17-13-8-5-11(15(19)22-2)9-14(13)23-16/h3-9H,1-2H3,(H,17,18)