S-tert-butyl (E)-5-phenylpent-2-enethioate

Systemtic Name: S-tert-butyl (E)-5-phenylpent-2-enethioate Openeye Name: S-tert-butyl (E)-5-phenylpent-2-enethioate CAS Name: (E)-5-phenyl-2-pentenethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl (E)-5-phenylpent-2-enethioate Traditional Name: (E)-5-phenylpent-2-enethioic acid S-tert-butyl ester Formula: C15H20OS MolecularWeight: 248.3837

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC(=O)C=CCCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)SC(=O)/C=C/CCC1=CC=CC=C1

InChI

InChI=1S/C15H20OS/c1-15(2,3)17-14(16)12-8-7-11-13-9-5-4-6-10-13/h4-6,8-10,12H,7,11H2,1-3H3/b12-8+