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

Systemtic Name: ethyl 1-ethyl-2-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-2-[2-(4-fluorophenyl)-2-oxo-ethyl]sulfanyl-benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-[[2-(4-fluorophenyl)-2-oxoethyl]thio]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanylbenzimidazole-5-carboxylate Traditional Name: 1-ethyl-2-[[2-(4-fluorophenyl)-2-keto-ethyl]thio]benzimidazole-5-carboxylic acid ethyl ester Formula: C20H19FN2O3S MolecularWeight: 386.439863

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H19FN2O3S/c1-3-23-17-10-7-14(19(25)26-4-2)11-16(17)22-20(23)27-12-18(24)13-5-8-15(21)9-6-13/h5-11H,3-4,12H2,1-2H3