4-[2-[1H-benzimidazol-2-ylmethyl(methyl)amino]-2-oxidanylidene-ethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[2-[1H-benzimidazol-2-ylmethyl(methyl)amino]-2-oxidanylidene-ethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-[2-[1H-benzimidazol-2-ylmethyl(methyl)amino]-2-oxo-ethyl]-5-(2-thienyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[2-[1H-benzimidazol-2-ylmethyl(methyl)amino]-2-oxoethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate IUPAC Name: 4-[2-[1H-benzimidazol-2-ylmethyl(methyl)amino]-2-oxoethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-[2-[1H-benzimidazol-2-ylmethyl(methyl)amino]-2-keto-ethyl]-5-(2-thienyl)-1,2,4-triazole-3-thiolate Formula: C17H15N6OS2- MolecularWeight: 383.4706

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2N1)C(=O)CN3C(=NN=C3[S-])C4=CC=CS4

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2N1)C(=O)CN3C(=NN=C3[S-])C4=CC=CS4

InChI

InChI=1S/C17H16N6OS2/c1-22(9-14-18-11-5-2-3-6-12(11)19-14)15(24)10-23-16(20-21-17(23)25)13-7-4-8-26-13/h2-8H,9-10H2,1H3,(H,18,19)(H,21,25)/p-1