(2R)-2-[[(2S)-2-benzamido-3-phenyl-propanoyl]amino]-4-methylsulfanyl-butanoate

Systemtic Name: (2R)-2-[[(2S)-2-benzamido-3-phenyl-propanoyl]amino]-4-methylsulfanyl-butanoate Openeye Name: (2R)-2-[[(2S)-2-benzamido-3-phenyl-propanoyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[(2S)-2-benzamido-1-oxo-3-phenylpropyl]amino]-4-(methylthio)butanoate IUPAC Name: (2R)-2-[[(2S)-2-benzamido-3-phenylpropanoyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[[(2S)-2-benzamido-3-phenyl-propanoyl]amino]-4-(methylthio)butyrate Formula: C21H23N2O4S- MolecularWeight: 399.48332

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CSCC[C@H](C(=O)[O-])NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H24N2O4S/c1-28-13-12-17(21(26)27)22-20(25)18(14-15-8-4-2-5-9-15)23-19(24)16-10-6-3-7-11-16/h2-11,17-18H,12-14H2,1H3,(H,22,25)(H,23,24)(H,26,27)/p-1/t17-,18+/m1/s1