(2S)-2-[(4S)-2-oxidanylidene-4-phenyl-1,3-oxazolidin-3-yl]-4-(phenylmethylsulfanyl)butanoic acid

Systemtic Name: (2S)-2-[(4S)-2-oxidanylidene-4-phenyl-1,3-oxazolidin-3-yl]-4-(phenylmethylsulfanyl)butanoic acid Openeye Name: (2S)-4-benzylsulfanyl-2-[(4S)-2-oxo-4-phenyl-oxazolidin-3-yl]butanoic acid CAS Name: (2S)-2-[(4S)-2-oxo-4-phenyl-3-oxazolidinyl]-4-(phenylmethylthio)butanoic acid IUPAC Name: (2S)-4-benzylsulfanyl-2-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]butanoic acid Traditional Name: (2S)-4-(benzylthio)-2-[(4S)-2-keto-4-phenyl-oxazolidin-3-yl]butyric acid Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C(=O)O1)C(CCSCC2=CC=CC=C2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1[C@@H](N(C(=O)O1)[C@@H](CCSCC2=CC=CC=C2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C20H21NO4S/c22-19(23)17(11-12-26-14-15-7-3-1-4-8-15)21-18(13-25-20(21)24)16-9-5-2-6-10-16/h1-10,17-18H,11-14H2,(H,22,23)/t17-,18+/m0/s1