S-ethyl 3-ethoxy-2,4-dimethyl-benzenecarbothioate

Systemtic Name: S-ethyl 3-ethoxy-2,4-dimethyl-benzenecarbothioate Openeye Name: S-ethyl 3-ethoxy-2,4-dimethyl-benzenecarbothioate CAS Name: 3-ethoxy-2,4-dimethylbenzenecarbothioic acid S-ethyl ester IUPAC Name: S-ethyl 3-ethoxy-2,4-dimethylbenzenecarbothioate Traditional Name: 3-ethoxy-2,4-dimethyl-thiobenzoic acid S-ethyl ester Formula: C13H18O2S MolecularWeight: 238.34582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1C)C(=O)SCC)C

Isomeric SMILES

CCOC1=C(C=CC(=C1C)C(=O)SCC)C

InChI

InChI=1S/C13H18O2S/c1-5-15-12-9(3)7-8-11(10(12)4)13(14)16-6-2/h7-8H,5-6H2,1-4H3