ethyl 1-ethyl-2-[2-(4-fluoranylphenoxy)ethylsulfanyl]benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-[2-(4-fluoranylphenoxy)ethylsulfanyl]benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-2-[2-(4-fluorophenoxy)ethylsulfanyl]benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-[2-(4-fluorophenoxy)ethylthio]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-[2-(4-fluorophenoxy)ethylsulfanyl]benzimidazole-5-carboxylate Traditional Name: 1-ethyl-2-[2-(4-fluorophenoxy)ethylthio]benzimidazole-5-carboxylic acid ethyl ester Formula: C20H21FN2O3S MolecularWeight: 388.455743

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCCOC3=CC=C(C=C3)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCCOC3=CC=C(C=C3)F

InChI

InChI=1S/C20H21FN2O3S/c1-3-23-18-10-5-14(19(24)25-4-2)13-17(18)22-20(23)27-12-11-26-16-8-6-15(21)7-9-16/h5-10,13H,3-4,11-12H2,1-2H3