[(2S,4S)-4-(acetyloxymethyl)-5-phenylsulfanyl-2-(phenylsulfanylmethyl)pentyl] ethanoate

Systemtic Name: [(2S,4S)-4-(acetyloxymethyl)-5-phenylsulfanyl-2-(phenylsulfanylmethyl)pentyl] ethanoate Openeye Name: [(2S,4S)-4-(acetoxymethyl)-5-phenylsulfanyl-2-(phenylsulfanylmethyl)pentyl] acetate CAS Name: acetic acid [(2S,4S)-4-(acetyloxymethyl)-5-(phenylthio)-2-[(phenylthio)methyl]pentyl] ester IUPAC Name: [(2S,4S)-4-(acetyloxymethyl)-5-phenylsulfanyl-2-(phenylsulfanylmethyl)pentyl] acetate Traditional Name: acetic acid [(2S,4S)-4-(acetoxymethyl)-5-(phenylthio)-2-[(phenylthio)methyl]pentyl] ester Formula: C23H28O4S2 MolecularWeight: 432.59602

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CC(COC(=O)C)CSC1=CC=CC=C1)CSC2=CC=CC=C2

Isomeric SMILES

CC(=O)OC[C@H](C[C@@H](COC(=O)C)CSC1=CC=CC=C1)CSC2=CC=CC=C2

InChI

InChI=1S/C23H28O4S2/c1-18(24)26-14-20(16-28-22-9-5-3-6-10-22)13-21(15-27-19(2)25)17-29-23-11-7-4-8-12-23/h3-12,20-21H,13-17H2,1-2H3/t20-,21-/m0/s1