S-(2,4,6-trimethylphenyl) (E)-5-phenylpent-2-enethioate

Systemtic Name: S-(2,4,6-trimethylphenyl) (E)-5-phenylpent-2-enethioate Openeye Name: S-(2,4,6-trimethylphenyl) (E)-5-phenylpent-2-enethioate CAS Name: (E)-5-phenyl-2-pentenethioic acid S-(2,4,6-trimethylphenyl) ester IUPAC Name: S-(2,4,6-trimethylphenyl) (E)-5-phenylpent-2-enethioate Traditional Name: (E)-5-phenylpent-2-enethioic acid S-mesityl ester Formula: C20H22OS MolecularWeight: 310.45308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)SC(=O)C=CCCC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)SC(=O)/C=C/CCC2=CC=CC=C2)C

InChI

InChI=1S/C20H22OS/c1-15-13-16(2)20(17(3)14-15)22-19(21)12-8-7-11-18-9-5-4-6-10-18/h4-6,8-10,12-14H,7,11H2,1-3H3/b12-8+