methyl 2-[2-(5-nitrothiophen-2-yl)-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboxylate

Systemtic Name: methyl 2-[2-(5-nitrothiophen-2-yl)-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboxylate Openeye Name: methyl 2-[2-(5-nitro-2-thienyl)-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboxylate CAS Name: 2-[2-(5-nitro-2-thiophenyl)-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-[2-(5-nitrothiophen-2-yl)-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboxylate Traditional Name: 2-[2-(5-nitro-2-thienyl)-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboxylic acid methyl ester Formula: C20H13N5O4S MolecularWeight: 419.41332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N=C(N2)C3=CC4=C(C=C3)N=C(N4)C5=CC=C(S5)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N=C(N2)C3=CC4=C(C=C3)N=C(N4)C5=CC=C(S5)[N+](=O)[O-]

InChI

InChI=1S/C20H13N5O4S/c1-29-20(26)11-3-5-12-15(9-11)23-18(21-12)10-2-4-13-14(8-10)24-19(22-13)16-6-7-17(30-16)25(27)28/h2-9H,1H3,(H,21,23)(H,22,24)