ethyl 2-[(2-chlorophenyl)methylsulfanyl]-1-(furan-2-ylmethyl)benzimidazole-5-carboxylate

Systemtic Name: ethyl 2-[(2-chlorophenyl)methylsulfanyl]-1-(furan-2-ylmethyl)benzimidazole-5-carboxylate Openeye Name: ethyl 2-[(2-chlorophenyl)methylsulfanyl]-1-(2-furylmethyl)benzimidazole-5-carboxylate CAS Name: 2-[(2-chlorophenyl)methylthio]-1-(2-furanylmethyl)-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-chlorophenyl)methylsulfanyl]-1-(furan-2-ylmethyl)benzimidazole-5-carboxylate Traditional Name: 2-[(2-chlorobenzyl)thio]-1-(2-furfuryl)benzimidazole-5-carboxylic acid ethyl ester Formula: C22H19ClN2O3S MolecularWeight: 426.91586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=CC=CC=C3Cl)CC4=CC=CO4

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=CC=CC=C3Cl)CC4=CC=CO4

InChI

InChI=1S/C22H19ClN2O3S/c1-2-27-21(26)15-9-10-20-19(12-15)24-22(25(20)13-17-7-5-11-28-17)29-14-16-6-3-4-8-18(16)23/h3-12H,2,13-14H2,1H3