2-[[(2S)-2-benzamido-4-methylsulfanyl-butanoyl]amino]ethanoic acid

Systemtic Name: 2-[[(2S)-2-benzamido-4-methylsulfanyl-butanoyl]amino]ethanoic acid Openeye Name: 2-[[(2S)-2-benzamido-4-methylsulfanyl-butanoyl]amino]acetic acid CAS Name: 2-[[(2S)-2-benzamido-4-(methylthio)-1-oxobutyl]amino]acetic acid IUPAC Name: 2-[[(2S)-2-benzamido-4-methylsulfanylbutanoyl]amino]acetic acid Traditional Name: 2-[[(2S)-2-benzamido-4-(methylthio)butanoyl]amino]acetic acid Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O4S/c1-21-8-7-11(14(20)15-9-12(17)18)16-13(19)10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H,15,20)(H,16,19)(H,17,18)/t11-/m0/s1