S-phenyl 3-[(E)-2-(3,5-dimethyl-4-oxidanyl-phenyl)ethenyl]benzenecarbothioate

Systemtic Name: S-phenyl 3-[(E)-2-(3,5-dimethyl-4-oxidanyl-phenyl)ethenyl]benzenecarbothioate Openeye Name: S-phenyl 3-[(E)-2-(4-hydroxy-3,5-dimethyl-phenyl)vinyl]benzenecarbothioate CAS Name: 3-[(E)-2-(4-hydroxy-3,5-dimethylphenyl)ethenyl]benzenecarbothioic acid S-phenyl ester IUPAC Name: S-phenyl 3-[(E)-2-(4-hydroxy-3,5-dimethylphenyl)ethenyl]benzenecarbothioate Traditional Name: 3-[(E)-2-(4-hydroxy-3,5-dimethyl-phenyl)vinyl]thiobenzoic acid S-phenyl ester Formula: C23H20O2S MolecularWeight: 360.4687

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C=CC2=CC(=CC=C2)C(=O)SC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC(=C1O)C)/C=C/C2=CC(=CC=C2)C(=O)SC3=CC=CC=C3

InChI

InChI=1S/C23H20O2S/c1-16-13-19(14-17(2)22(16)24)12-11-18-7-6-8-20(15-18)23(25)26-21-9-4-3-5-10-21/h3-15,24H,1-2H3/b12-11+