2-[6-[2-(methylamino)-2-sulfanylidene-ethyl]-2-sulfanylidene-3H-benzimidazol-1-yl]ethanoic acid

Systemtic Name: 2-[6-[2-(methylamino)-2-sulfanylidene-ethyl]-2-sulfanylidene-3H-benzimidazol-1-yl]ethanoic acid Openeye Name: 2-[6-[2-(methylamino)-2-thioxo-ethyl]-2-thioxo-3H-benzimidazol-1-yl]acetic acid CAS Name: 2-[6-[2-(methylamino)-2-sulfanylideneethyl]-2-sulfanylidene-3H-benzimidazol-1-yl]acetic acid IUPAC Name: 2-[6-[2-(methylamino)-2-sulfanylideneethyl]-2-sulfanylidene-3H-benzimidazol-1-yl]acetic acid Traditional Name: 2-[6-[2-(methylamino)-2-thioxo-ethyl]-2-thioxo-3H-benzimidazol-1-yl]acetic acid Formula: C12H13N3O2S2 MolecularWeight: 295.38052

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)CC1=CC2=C(C=C1)NC(=S)N2CC(=O)O

Isomeric SMILES

CNC(=S)CC1=CC2=C(C=C1)NC(=S)N2CC(=O)O

InChI

InChI=1S/C12H13N3O2S2/c1-13-10(18)5-7-2-3-8-9(4-7)15(6-11(16)17)12(19)14-8/h2-4H,5-6H2,1H3,(H,13,18)(H,14,19)(H,16,17)