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

Systemtic Name: ethyl 1-ethyl-2-[2-(phenylsulfonyl)ethylsulfanyl]benzimidazole-5-carboxylate Openeye Name: ethyl 2-[2-(benzenesulfonyl)ethylsulfanyl]-1-ethyl-benzimidazole-5-carboxylate CAS Name: 2-[2-(benzenesulfonyl)ethylthio]-1-ethyl-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(benzenesulfonyl)ethylsulfanyl]-1-ethylbenzimidazole-5-carboxylate Traditional Name: 2-(2-besylethylthio)-1-ethyl-benzimidazole-5-carboxylic acid ethyl ester Formula: C20H22N2O4S2 MolecularWeight: 418.52968

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22N2O4S2/c1-3-22-18-11-10-15(19(23)26-4-2)14-17(18)21-20(22)27-12-13-28(24,25)16-8-6-5-7-9-16/h5-11,14H,3-4,12-13H2,1-2H3