S-(4-cyanophenyl) 5-methoxy-2-prop-2-enyl-benzenecarbothioate

Systemtic Name: S-(4-cyanophenyl) 5-methoxy-2-prop-2-enyl-benzenecarbothioate Openeye Name: S-(4-cyanophenyl) 2-allyl-5-methoxy-benzenecarbothioate CAS Name: 5-methoxy-2-prop-2-enylbenzenecarbothioic acid S-(4-cyanophenyl) ester IUPAC Name: S-(4-cyanophenyl) 5-methoxy-2-prop-2-enylbenzenecarbothioate Traditional Name: 2-allyl-5-methoxy-thiobenzoic acid S-(4-cyanophenyl) ester Formula: C18H15NO2S MolecularWeight: 309.3822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CC=C)C(=O)SC2=CC=C(C=C2)C#N

Isomeric SMILES

COC1=CC(=C(C=C1)CC=C)C(=O)SC2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H15NO2S/c1-3-4-14-7-8-15(21-2)11-17(14)18(20)22-16-9-5-13(12-19)6-10-16/h3,5-11H,1,4H2,2H3