ethyl 1-ethyl-2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-[(3-fluoro-4-methoxyphenyl)methylthio]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]benzimidazole-5-carboxylate Traditional Name: 1-ethyl-2-[(3-fluoro-4-methoxy-benzyl)thio]benzimidazole-5-carboxylic acid ethyl ester Formula: C20H21FN2O3S MolecularWeight: 388.455743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C20H21FN2O3S/c1-4-23-17-8-7-14(19(24)26-5-2)11-16(17)22-20(23)27-12-13-6-9-18(25-3)15(21)10-13/h6-11H,4-5,12H2,1-3H3