4-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]thiazole-2-carboxylic acid CAS Name: 4-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]thiazole-2-carboxylic acid Formula: C13H11N3O3S2 MolecularWeight: 321.37474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)SCC3=CSC(=N3)C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)SCC3=CSC(=N3)C(=O)O

InChI

InChI=1S/C13H11N3O3S2/c1-19-8-2-3-9-10(4-8)16-13(15-9)21-6-7-5-20-11(14-7)12(17)18/h2-5H,6H2,1H3,(H,15,16)(H,17,18)