methyl 1-azanyl-2-sulfanylidene-3H-benzimidazole-5-carboxylate

Systemtic Name: methyl 1-azanyl-2-sulfanylidene-3H-benzimidazole-5-carboxylate Openeye Name: methyl 1-amino-2-thioxo-3H-benzimidazole-5-carboxylate CAS Name: 1-amino-2-sulfanylidene-3H-benzimidazole-5-carboxylic acid methyl ester IUPAC Name: methyl 1-amino-2-sulfanylidene-3H-benzimidazole-5-carboxylate Traditional Name: 1-amino-2-thioxo-3H-benzimidazole-5-carboxylic acid methyl ester Formula: C9H9N3O2S MolecularWeight: 223.25166

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N(C(=S)N2)N

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N(C(=S)N2)N

InChI

InChI=1S/C9H9N3O2S/c1-14-8(13)5-2-3-7-6(4-5)11-9(15)12(7)10/h2-4H,10H2,1H3,(H,11,15)