(4-methylsulfanylphenyl)methyl (2S)-2-[(4-bromophenyl)carbonylamino]propanoate

Systemtic Name: (4-methylsulfanylphenyl)methyl (2S)-2-[(4-bromophenyl)carbonylamino]propanoate Openeye Name: (4-methylsulfanylphenyl)methyl (2S)-2-[(4-bromobenzoyl)amino]propanoate CAS Name: (2S)-2-[[(4-bromophenyl)-oxomethyl]amino]propanoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl (2S)-2-[(4-bromobenzoyl)amino]propanoate Traditional Name: (2S)-2-[(4-bromobenzoyl)amino]propionic acid [4-(methylthio)benzyl] ester Formula: C18H18BrNO3S MolecularWeight: 408.30942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=C(C=C1)SC)NC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C[C@@H](C(=O)OCC1=CC=C(C=C1)SC)NC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H18BrNO3S/c1-12(20-17(21)14-5-7-15(19)8-6-14)18(22)23-11-13-3-9-16(24-2)10-4-13/h3-10,12H,11H2,1-2H3,(H,20,21)/t12-/m0/s1