(2S)-2-[(3-bromophenyl)carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: (2S)-2-[(3-bromophenyl)carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: (2S)-2-[(3-bromobenzoyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: (2S)-2-[[(3-bromophenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: (2S)-2-[(3-bromobenzoyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: (2S)-2-[(3-bromobenzoyl)amino]-4-(methylthio)butyric acid Formula: C12H14BrNO3S MolecularWeight: 332.21346

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)C1=CC(=CC=C1)Br

Isomeric SMILES

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

InChI

InChI=1S/C12H14BrNO3S/c1-18-6-5-10(12(16)17)14-11(15)8-3-2-4-9(13)7-8/h2-4,7,10H,5-6H2,1H3,(H,14,15)(H,16,17)/t10-/m0/s1