(2-oxidanylidene-2-phenylazanyl-ethyl) (2R)-2-[(4-bromophenyl)methylsulfanyl]propanoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) (2R)-2-[(4-bromophenyl)methylsulfanyl]propanoate Openeye Name: (2-anilino-2-oxo-ethyl) (2R)-2-[(4-bromophenyl)methylsulfanyl]propanoate CAS Name: (2R)-2-[(4-bromophenyl)methylthio]propanoic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) (2R)-2-[(4-bromophenyl)methylsulfanyl]propanoate Traditional Name: (2R)-2-[(4-bromobenzyl)thio]propionic acid (2-anilino-2-keto-ethyl) ester Formula: C18H18BrNO3S MolecularWeight: 408.30942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1=CC=CC=C1)SCC2=CC=C(C=C2)Br

Isomeric SMILES

C[C@H](C(=O)OCC(=O)NC1=CC=CC=C1)SCC2=CC=C(C=C2)Br

InChI

InChI=1S/C18H18BrNO3S/c1-13(24-12-14-7-9-15(19)10-8-14)18(22)23-11-17(21)20-16-5-3-2-4-6-16/h2-10,13H,11-12H2,1H3,(H,20,21)/t13-/m1/s1