(phenylmethyl) 2-(6-thiophen-2-yl-1H-benzimidazol-2-yl)pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-(6-thiophen-2-yl-1H-benzimidazol-2-yl)pyrrolidine-1-carboxylate Openeye Name: benzyl 2-[6-(2-thienyl)-1H-benzimidazol-2-yl]pyrrolidine-1-carboxylate CAS Name: 2-(6-thiophen-2-yl-1H-benzimidazol-2-yl)-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(6-thiophen-2-yl-1H-benzimidazol-2-yl)pyrrolidine-1-carboxylate Traditional Name: 2-[6-(2-thienyl)-1H-benzimidazol-2-yl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C23H21N3O2S MolecularWeight: 403.49674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C3=NC4=C(N3)C=C(C=C4)C5=CC=CS5

Isomeric SMILES

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C3=NC4=C(N3)C=C(C=C4)C5=CC=CS5

InChI

InChI=1S/C23H21N3O2S/c27-23(28-15-16-6-2-1-3-7-16)26-12-4-8-20(26)22-24-18-11-10-17(14-19(18)25-22)21-9-5-13-29-21/h1-3,5-7,9-11,13-14,20H,4,8,12,15H2,(H,24,25)