imidazo[1,2-a]pyridin-2-ylmethyl (2R)-2-[(4-bromophenyl)methylsulfanyl]propanoate

Systemtic Name: imidazo[1,2-a]pyridin-2-ylmethyl (2R)-2-[(4-bromophenyl)methylsulfanyl]propanoate Openeye Name: imidazo[1,2-a]pyridin-2-ylmethyl (2R)-2-[(4-bromophenyl)methylsulfanyl]propanoate CAS Name: (2R)-2-[(4-bromophenyl)methylthio]propanoic acid 2-imidazo[1,2-a]pyridinylmethyl ester IUPAC Name: imidazo[1,2-a]pyridin-2-ylmethyl (2R)-2-[(4-bromophenyl)methylsulfanyl]propanoate Traditional Name: (2R)-2-[(4-bromobenzyl)thio]propionic acid imidazo[1,2-a]pyridin-2-ylmethyl ester Formula: C18H17BrN2O2S MolecularWeight: 405.30878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CN2C=CC=CC2=N1)SCC3=CC=C(C=C3)Br

Isomeric SMILES

C[C@H](C(=O)OCC1=CN2C=CC=CC2=N1)SCC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H17BrN2O2S/c1-13(24-12-14-5-7-15(19)8-6-14)18(22)23-11-16-10-21-9-3-2-4-17(21)20-16/h2-10,13H,11-12H2,1H3/t13-/m1/s1