ethyl 3,4-bis(phenylsulfanyl)butanoate

Systemtic Name: ethyl 3,4-bis(phenylsulfanyl)butanoate Openeye Name: ethyl 3,4-bis(phenylsulfanyl)butanoate CAS Name: 3,4-bis(phenylthio)butanoic acid ethyl ester IUPAC Name: ethyl 3,4-bis(phenylsulfanyl)butanoate Traditional Name: 3,4-bis(phenylthio)butyric acid ethyl ester Formula: C18H20O2S2 MolecularWeight: 332.4802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CSC1=CC=CC=C1)SC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CC(CSC1=CC=CC=C1)SC2=CC=CC=C2

InChI

InChI=1S/C18H20O2S2/c1-2-20-18(19)13-17(22-16-11-7-4-8-12-16)14-21-15-9-5-3-6-10-15/h3-12,17H,2,13-14H2,1H3