methyl 2-[4-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoyl]phenoxy]ethanoate hydrobromide

Systemtic Name: methyl 2-[4-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoyl]phenoxy]ethanoate hydrobromide Openeye Name: methyl 2-[4-[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]phenoxy]acetate hydrobromide CAS Name: 2-[4-[2-(1H-benzimidazol-2-ylthio)-1-oxoethyl]phenoxy]acetic acid methyl ester hydrobromide IUPAC Name: methyl 2-[4-[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]phenoxy]acetate hydrobromide Traditional Name: 2-[4-[2-(1H-benzimidazol-2-ylthio)acetyl]phenoxy]acetic acid methyl ester hydrobromide Formula: C18H17BrN2O4S MolecularWeight: 437.30758

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3N2.Br

Isomeric SMILES

COC(=O)COC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3N2.Br

InChI

InChI=1S/C18H16N2O4S.BrH/c1-23-17(22)10-24-13-8-6-12(7-9-13)16(21)11-25-18-19-14-4-2-3-5-15(14)20-18;/h2-9H,10-11H2,1H3,(H,19,20);1H