ethyl 1-ethyl-2-[(1R)-1-(4-fluorophenyl)ethyl]sulfanyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-[(1R)-1-(4-fluorophenyl)ethyl]sulfanyl-benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-2-[(1R)-1-(4-fluorophenyl)ethyl]sulfanyl-benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-[[(1R)-1-(4-fluorophenyl)ethyl]thio]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-[(1R)-1-(4-fluorophenyl)ethyl]sulfanylbenzimidazole-5-carboxylate Traditional Name: 1-ethyl-2-[[(1R)-1-(4-fluorophenyl)ethyl]thio]benzimidazole-5-carboxylic acid ethyl ester Formula: C20H21FN2O2S MolecularWeight: 372.456343

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SC(C)C3=CC=C(C=C3)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1S[C@H](C)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H21FN2O2S/c1-4-23-18-11-8-15(19(24)25-5-2)12-17(18)22-20(23)26-13(3)14-6-9-16(21)10-7-14/h6-13H,4-5H2,1-3H3/t13-/m1/s1