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

Systemtic Name: S-(4-chlorophenyl) 4-butoxy-3,5-bis(chloranyl)benzenecarbothioate Openeye Name: S-(4-chlorophenyl) 4-butoxy-3,5-dichloro-benzenecarbothioate CAS Name: 4-butoxy-3,5-dichlorobenzenecarbothioic acid S-(4-chlorophenyl) ester IUPAC Name: S-(4-chlorophenyl) 4-butoxy-3,5-dichlorobenzenecarbothioate Traditional Name: 4-butoxy-3,5-dichloro-thiobenzoic acid S-(4-chlorophenyl) ester Formula: C17H15Cl3O2S MolecularWeight: 389.7238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15Cl3O2S/c1-2-3-8-22-16-14(19)9-11(10-15(16)20)17(21)23-13-6-4-12(18)5-7-13/h4-7,9-10H,2-3,8H2,1H3