[2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] (2S)-2-[(4-bromophenyl)methylsulfanyl]propanoate

Systemtic Name: [2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] (2S)-2-[(4-bromophenyl)methylsulfanyl]propanoate Openeye Name: [2-(methylcarbamoylamino)-2-oxo-ethyl] (2S)-2-[(4-bromophenyl)methylsulfanyl]propanoate CAS Name: (2S)-2-[(4-bromophenyl)methylthio]propanoic acid [2-(methylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylcarbamoylamino)-2-oxoethyl] (2S)-2-[(4-bromophenyl)methylsulfanyl]propanoate Traditional Name: (2S)-2-[(4-bromobenzyl)thio]propionic acid [2-keto-2-(methylcarbamoylamino)ethyl] ester Formula: C14H17BrN2O4S MolecularWeight: 389.26478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC(=O)NC)SCC1=CC=C(C=C1)Br

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NC(=O)NC)SCC1=CC=C(C=C1)Br

InChI

InChI=1S/C14H17BrN2O4S/c1-9(22-8-10-3-5-11(15)6-4-10)13(19)21-7-12(18)17-14(20)16-2/h3-6,9H,7-8H2,1-2H3,(H2,16,17,18,20)/t9-/m0/s1