S-ethyl 2-methylidene-3-oxidanyl-5-phenyl-pentanethioate

Systemtic Name: S-ethyl 2-methylidene-3-oxidanyl-5-phenyl-pentanethioate Openeye Name: S-ethyl 3-hydroxy-2-methylene-5-phenyl-pentanethioate CAS Name: 3-hydroxy-2-methylene-5-phenylpentanethioic acid S-ethyl ester IUPAC Name: S-ethyl 3-hydroxy-2-methylidene-5-phenylpentanethioate Traditional Name: 2-(1-hydroxy-3-phenyl-propyl)prop-2-enethioic acid S-ethyl ester Formula: C14H18O2S MolecularWeight: 250.35652

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)C(=C)C(CCC1=CC=CC=C1)O

Isomeric SMILES

CCSC(=O)C(=C)C(CCC1=CC=CC=C1)O

InChI

InChI=1S/C14H18O2S/c1-3-17-14(16)11(2)13(15)10-9-12-7-5-4-6-8-12/h4-8,13,15H,2-3,9-10H2,1H3