3-methyl-5-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]benzoic acid

Systemtic Name: 3-methyl-5-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]benzoic acid Openeye Name: 3-methyl-5-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]benzoic acid CAS Name: 3-methyl-5-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]benzoic acid IUPAC Name: 3-methyl-5-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]benzoic acid Traditional Name: 3-methyl-5-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]benzoic acid Formula: C16H14N2O4S2 MolecularWeight: 362.42336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)O)NS(=O)(=O)C2=CC3=C(C=C2)N=C(S3)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)O)NS(=O)(=O)C2=CC3=C(C=C2)N=C(S3)C

InChI

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