S-ethyl 3-prop-2-enylbenzenecarbothioate

Systemtic Name: S-ethyl 3-prop-2-enylbenzenecarbothioate Openeye Name: S-ethyl 3-allylbenzenecarbothioate CAS Name: 3-prop-2-enylbenzenecarbothioic acid S-ethyl ester IUPAC Name: S-ethyl 3-prop-2-enylbenzenecarbothioate Traditional Name: 3-allylthiobenzoic acid S-ethyl ester Formula: C12H14OS MolecularWeight: 206.30396

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)C1=CC(=CC=C1)CC=C

Isomeric SMILES

CCSC(=O)C1=CC(=CC=C1)CC=C

InChI

InChI=1S/C12H14OS/c1-3-6-10-7-5-8-11(9-10)12(13)14-4-2/h3,5,7-9H,1,4,6H2,2H3