S-phenyl (E)-2-(phenylmethyl)pent-3-enethioate

Systemtic Name: S-phenyl (E)-2-(phenylmethyl)pent-3-enethioate Openeye Name: S-phenyl (E)-2-benzylpent-3-enethioate CAS Name: (E)-2-(phenylmethyl)-3-pentenethioic acid S-phenyl ester IUPAC Name: S-phenyl (E)-2-benzylpent-3-enethioate Traditional Name: (E)-2-benzylpent-3-enethioic acid S-phenyl ester Formula: C18H18OS MolecularWeight: 282.39992

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(CC1=CC=CC=C1)C(=O)SC2=CC=CC=C2

Isomeric SMILES

C/C=C/C(CC1=CC=CC=C1)C(=O)SC2=CC=CC=C2

InChI

InChI=1S/C18H18OS/c1-2-9-16(14-15-10-5-3-6-11-15)18(19)20-17-12-7-4-8-13-17/h2-13,16H,14H2,1H3/b9-2+