(4-bromophenyl)methyl 2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]ethanoate

Systemtic Name: (4-bromophenyl)methyl 2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]ethanoate Openeye Name: (4-bromophenyl)methyl 2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]acetate CAS Name: 2-[2-[(methylthio)methyl]-1-benzimidazolyl]acetic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]acetate Traditional Name: 2-[2-[(methylthio)methyl]benzimidazol-1-yl]acetic acid (4-bromobenzyl) ester Formula: C18H17BrN2O2S MolecularWeight: 405.30878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCC1=NC2=CC=CC=C2N1CC(=O)OCC3=CC=C(C=C3)Br

Isomeric SMILES

CSCC1=NC2=CC=CC=C2N1CC(=O)OCC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H17BrN2O2S/c1-24-12-17-20-15-4-2-3-5-16(15)21(17)10-18(22)23-11-13-6-8-14(19)9-7-13/h2-9H,10-12H2,1H3