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

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl] (2R)-2-[(4-bromophenyl)methylsulfanyl]propanoate Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl] (2R)-2-[(4-bromophenyl)methylsulfanyl]propanoate CAS Name: (2R)-2-[(4-bromophenyl)methylthio]propanoic acid [2-(cyclopropylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl] (2R)-2-[(4-bromophenyl)methylsulfanyl]propanoate Traditional Name: (2R)-2-[(4-bromobenzyl)thio]propionic acid [2-(cyclopropylamino)-2-keto-ethyl] ester Formula: C15H18BrNO3S MolecularWeight: 372.27732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1CC1)SCC2=CC=C(C=C2)Br

Isomeric SMILES

C[C@H](C(=O)OCC(=O)NC1CC1)SCC2=CC=C(C=C2)Br

InChI

InChI=1S/C15H18BrNO3S/c1-10(21-9-11-2-4-12(16)5-3-11)15(19)20-8-14(18)17-13-6-7-13/h2-5,10,13H,6-9H2,1H3,(H,17,18)/t10-/m1/s1