[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]ethanoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]ethanoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]acetate CAS Name: 2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]acetic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]acetate Traditional Name: 2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]acetic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C19H17BrN2O4S MolecularWeight: 449.31828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N2)SCC(=O)OCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N2)SCC(=O)OCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H17BrN2O4S/c1-2-25-14-7-8-15-16(9-14)22-19(21-15)27-11-18(24)26-10-17(23)12-3-5-13(20)6-4-12/h3-9H,2,10-11H2,1H3,(H,21,22)