6-methyl-2-(2-methylquinolin-6-yl)-1,3-benzothiazole-7-sulfonic acid

Systemtic Name: 6-methyl-2-(2-methylquinolin-6-yl)-1,3-benzothiazole-7-sulfonic acid Openeye Name: 6-methyl-2-(2-methyl-6-quinolyl)-1,3-benzothiazole-7-sulfonic acid CAS Name: 6-methyl-2-(2-methyl-6-quinolinyl)-1,3-benzothiazole-7-sulfonic acid IUPAC Name: 6-methyl-2-(2-methylquinolin-6-yl)-1,3-benzothiazole-7-sulfonic acid Traditional Name: 6-methyl-2-(2-methyl-6-quinolyl)-1,3-benzothiazole-7-sulfonic acid Formula: C18H14N2O3S2 MolecularWeight: 370.44536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)N=C(S2)C3=CC4=C(C=C3)N=C(C=C4)C)S(=O)(=O)O

Isomeric SMILES

CC1=C(C2=C(C=C1)N=C(S2)C3=CC4=C(C=C3)N=C(C=C4)C)S(=O)(=O)O

InChI

InChI=1S/C18H14N2O3S2/c1-10-3-7-15-16(17(10)25(21,22)23)24-18(20-15)13-6-8-14-12(9-13)5-4-11(2)19-14/h3-9H,1-2H3,(H,21,22,23)