methyl 6-[(2-methoxycarbonyl-3H-benzimidazol-5-yl)disulfanyl]-1H-benzimidazole-2-carboxylate

Systemtic Name: methyl 6-[(2-methoxycarbonyl-3H-benzimidazol-5-yl)disulfanyl]-1H-benzimidazole-2-carboxylate Openeye Name: methyl 6-[(2-methoxycarbonyl-3H-benzimidazol-5-yl)disulfanyl]-1H-benzimidazole-2-carboxylate CAS Name: 6-[(2-methoxycarbonyl-3H-benzimidazol-5-yl)disulfanyl]-1H-benzimidazole-2-carboxylic acid methyl ester IUPAC Name: methyl 6-[(2-methoxycarbonyl-3H-benzimidazol-5-yl)disulfanyl]-1H-benzimidazole-2-carboxylate Traditional Name: 6-[(2-carbomethoxy-3H-benzimidazol-5-yl)disulfanyl]-1H-benzimidazole-2-carboxylic acid methyl ester Formula: C18H14N4O4S2 MolecularWeight: 414.45816

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC2=C(N1)C=C(C=C2)SSC3=CC4=C(C=C3)N=C(N4)C(=O)OC

Isomeric SMILES

COC(=O)C1=NC2=C(N1)C=C(C=C2)SSC3=CC4=C(C=C3)N=C(N4)C(=O)OC

InChI

InChI=1S/C18H14N4O4S2/c1-25-17(23)15-19-11-5-3-9(7-13(11)21-15)27-28-10-4-6-12-14(8-10)22-16(20-12)18(24)26-2/h3-8H,1-2H3,(H,19,21)(H,20,22)