(2S)-2-[[(3R)-3-benzamido-3-phenyl-propanoyl]amino]-3-methylsulfanyl-propanoate

Systemtic Name: (2S)-2-[[(3R)-3-benzamido-3-phenyl-propanoyl]amino]-3-methylsulfanyl-propanoate Openeye Name: (2S)-2-[[(3R)-3-benzamido-3-phenyl-propanoyl]amino]-3-methylsulfanyl-propanoate CAS Name: (2S)-2-[[(3R)-3-benzamido-1-oxo-3-phenylpropyl]amino]-3-(methylthio)propanoate IUPAC Name: (2S)-2-[[(3R)-3-benzamido-3-phenylpropanoyl]amino]-3-methylsulfanylpropanoate Traditional Name: (2S)-2-[[(3R)-3-benzamido-3-phenyl-propanoyl]amino]-3-(methylthio)propionate Formula: C20H21N2O4S- MolecularWeight: 385.45674

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(C(=O)[O-])NC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CSC[C@H](C(=O)[O-])NC(=O)C[C@H](C1=CC=CC=C1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H22N2O4S/c1-27-13-17(20(25)26)21-18(23)12-16(14-8-4-2-5-9-14)22-19(24)15-10-6-3-7-11-15/h2-11,16-17H,12-13H2,1H3,(H,21,23)(H,22,24)(H,25,26)/p-1/t16-,17-/m1/s1