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

Systemtic Name: S-(4-methylphenyl) 4-butoxy-3,5-bis(chloranyl)benzenecarbothioate Openeye Name: S-(p-tolyl) 4-butoxy-3,5-dichloro-benzenecarbothioate CAS Name: 4-butoxy-3,5-dichlorobenzenecarbothioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) 4-butoxy-3,5-dichlorobenzenecarbothioate Traditional Name: 4-butoxy-3,5-dichloro-thiobenzoic acid S-(p-tolyl) ester Formula: C18H18Cl2O2S MolecularWeight: 369.30532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)C(=O)SC2=CC=C(C=C2)C)Cl

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)C(=O)SC2=CC=C(C=C2)C)Cl

InChI

InChI=1S/C18H18Cl2O2S/c1-3-4-9-22-17-15(19)10-13(11-16(17)20)18(21)23-14-7-5-12(2)6-8-14/h5-8,10-11H,3-4,9H2,1-2H3