ethyl 4-methyl-3-oxidanyl-4-phenylsulfanyl-pentanedithioate

Systemtic Name: ethyl 4-methyl-3-oxidanyl-4-phenylsulfanyl-pentanedithioate Openeye Name: ethyl 3-hydroxy-4-methyl-4-phenylsulfanyl-pentanedithioate CAS Name: 3-hydroxy-4-methyl-4-(phenylthio)pentanedithioic acid ethyl ester IUPAC Name: ethyl 3-hydroxy-4-methyl-4-phenylsulfanylpentanedithioate Traditional Name: 3-hydroxy-4-methyl-4-(phenylthio)pentanedithioic acid ethyl ester Formula: C14H20OS3 MolecularWeight: 300.503

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=S)CC(C(C)(C)SC1=CC=CC=C1)O

Isomeric SMILES

CCSC(=S)CC(C(C)(C)SC1=CC=CC=C1)O

InChI

InChI=1S/C14H20OS3/c1-4-17-13(16)10-12(15)14(2,3)18-11-8-6-5-7-9-11/h5-9,12,15H,4,10H2,1-3H3