ethyl 3-[2-(4-bromophenyl)sulfonylethyl]-1-ethyl-2-oxidanylidene-benzimidazole-5-carboxylate

Systemtic Name: ethyl 3-[2-(4-bromophenyl)sulfonylethyl]-1-ethyl-2-oxidanylidene-benzimidazole-5-carboxylate Openeye Name: ethyl 3-[2-(4-bromophenyl)sulfonylethyl]-1-ethyl-2-oxo-benzimidazole-5-carboxylate CAS Name: 3-[2-(4-bromophenyl)sulfonylethyl]-1-ethyl-2-oxo-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[2-(4-bromophenyl)sulfonylethyl]-1-ethyl-2-oxobenzimidazole-5-carboxylate Traditional Name: 3-(2-brosylethyl)-1-ethyl-2-keto-benzimidazole-5-carboxylic acid ethyl ester Formula: C20H21BrN2O5S MolecularWeight: 481.36014

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N(C1=O)CCS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N(C1=O)CCS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H21BrN2O5S/c1-3-22-17-10-5-14(19(24)28-4-2)13-18(17)23(20(22)25)11-12-29(26,27)16-8-6-15(21)7-9-16/h5-10,13H,3-4,11-12H2,1-2H3