dimethyl 2-(1H-benzimidazol-2-yl)-2,5-diphenyl-3H-thiophene-3,4-dicarboxylate

Systemtic Name: dimethyl 2-(1H-benzimidazol-2-yl)-2,5-diphenyl-3H-thiophene-3,4-dicarboxylate Openeye Name: dimethyl 2-(1H-benzimidazol-2-yl)-2,5-diphenyl-3H-thiophene-3,4-dicarboxylate CAS Name: 2-(1H-benzimidazol-2-yl)-2,5-diphenyl-3H-thiophene-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(1H-benzimidazol-2-yl)-2,5-diphenyl-3H-thiophene-3,4-dicarboxylate Traditional Name: 2-(1H-benzimidazol-2-yl)-2,5-diphenyl-3H-thiophene-3,4-dicarboxylic acid dimethyl ester Formula: C27H22N2O4S MolecularWeight: 470.53958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(=C(SC1(C2=CC=CC=C2)C3=NC4=CC=CC=C4N3)C5=CC=CC=C5)C(=O)OC

Isomeric SMILES

COC(=O)C1C(=C(SC1(C2=CC=CC=C2)C3=NC4=CC=CC=C4N3)C5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C27H22N2O4S/c1-32-24(30)21-22(25(31)33-2)27(18-13-7-4-8-14-18,34-23(21)17-11-5-3-6-12-17)26-28-19-15-9-10-16-20(19)29-26/h3-16,22H,1-2H3,(H,28,29)