S-(4-methylphenyl) 3,5-bis(chloranyl)-4-hexoxy-benzenecarbothioate

Systemtic Name: S-(4-methylphenyl) 3,5-bis(chloranyl)-4-hexoxy-benzenecarbothioate Openeye Name: S-(p-tolyl) 3,5-dichloro-4-hexoxy-benzenecarbothioate CAS Name: 3,5-dichloro-4-hexoxybenzenecarbothioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) 3,5-dichloro-4-hexoxybenzenecarbothioate Traditional Name: 3,5-dichloro-4-hexoxy-thiobenzoic acid S-(p-tolyl) ester Formula: C20H22Cl2O2S MolecularWeight: 397.35848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1Cl)C(=O)SC2=CC=C(C=C2)C)Cl

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1Cl)C(=O)SC2=CC=C(C=C2)C)Cl

InChI

InChI=1S/C20H22Cl2O2S/c1-3-4-5-6-11-24-19-17(21)12-15(13-18(19)22)20(23)25-16-9-7-14(2)8-10-16/h7-10,12-13H,3-6,11H2,1-2H3