phenylsulfanyl (2S,3S)-2,4-dimethyl-3-oxidanyl-4-(phenylmethylsulfanyl)pentanoate

Systemtic Name: phenylsulfanyl (2S,3S)-2,4-dimethyl-3-oxidanyl-4-(phenylmethylsulfanyl)pentanoate Openeye Name: phenylsulfanyl (2S,3S)-4-benzylsulfanyl-3-hydroxy-2,4-dimethyl-pentanoate CAS Name: (2S,3S)-3-hydroxy-2,4-dimethyl-4-(phenylmethylthio)pentanoic acid (phenylthio) ester IUPAC Name: phenylsulfanyl (2S,3S)-4-benzylsulfanyl-3-hydroxy-2,4-dimethylpentanoate Traditional Name: (2S,3S)-4-(benzylthio)-3-hydroxy-2,4-dimethyl-valeric acid (phenylthio) ester Formula: C20H24O3S2 MolecularWeight: 376.53276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(C)(C)SCC1=CC=CC=C1)O)C(=O)OSC2=CC=CC=C2

Isomeric SMILES

C[C@@H]([C@@H](C(C)(C)SCC1=CC=CC=C1)O)C(=O)OSC2=CC=CC=C2

InChI

InChI=1S/C20H24O3S2/c1-15(19(22)23-25-17-12-8-5-9-13-17)18(21)20(2,3)24-14-16-10-6-4-7-11-16/h4-13,15,18,21H,14H2,1-3H3/t15-,18-/m0/s1