ethyl (2S,3S)-2-ethyl-5-phenylmethoxy-3-phenylsulfanyl-pentanoate

Systemtic Name: ethyl (2S,3S)-2-ethyl-5-phenylmethoxy-3-phenylsulfanyl-pentanoate Openeye Name: ethyl (2S,3S)-5-benzyloxy-2-ethyl-3-phenylsulfanyl-pentanoate CAS Name: (2S,3S)-2-ethyl-5-phenylmethoxy-3-(phenylthio)pentanoic acid ethyl ester IUPAC Name: ethyl (2S,3S)-2-ethyl-5-phenylmethoxy-3-phenylsulfanylpentanoate Traditional Name: (2S,3S)-5-benzoxy-2-ethyl-3-(phenylthio)valeric acid ethyl ester Formula: C22H28O3S MolecularWeight: 372.52092

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CCOCC1=CC=CC=C1)SC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CC[C@H]([C@H](CCOCC1=CC=CC=C1)SC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C22H28O3S/c1-3-20(22(23)25-4-2)21(26-19-13-9-6-10-14-19)15-16-24-17-18-11-7-5-8-12-18/h5-14,20-21H,3-4,15-17H2,1-2H3/t20-,21+/m1/s1