2-methyl-5-(1-methylbenzimidazol-2-yl)thiophene-3-sulfonic acid

Systemtic Name: 2-methyl-5-(1-methylbenzimidazol-2-yl)thiophene-3-sulfonic acid Openeye Name: 2-methyl-5-(1-methylbenzimidazol-2-yl)thiophene-3-sulfonic acid CAS Name: 2-methyl-5-(1-methyl-2-benzimidazolyl)-3-thiophenesulfonic acid IUPAC Name: 2-methyl-5-(1-methylbenzimidazol-2-yl)thiophene-3-sulfonic acid Traditional Name: 2-methyl-5-(1-methylbenzimidazol-2-yl)thiophene-3-sulfonic acid Formula: C13H12N2O3S2 MolecularWeight: 308.37598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C2=NC3=CC=CC=C3N2C)S(=O)(=O)O

Isomeric SMILES

CC1=C(C=C(S1)C2=NC3=CC=CC=C3N2C)S(=O)(=O)O

InChI

InChI=1S/C13H12N2O3S2/c1-8-12(20(16,17)18)7-11(19-8)13-14-9-5-3-4-6-10(9)15(13)2/h3-7H,1-2H3,(H,16,17,18)