S-[6-[2,4-bis(chloranyl)-6-phenyl-phenyl]hexyl] ethanethioate

Systemtic Name: S-[6-[2,4-bis(chloranyl)-6-phenyl-phenyl]hexyl] ethanethioate Openeye Name: S-[6-(2,4-dichloro-6-phenyl-phenyl)hexyl] ethanethioate CAS Name: ethanethioic acid S-[6-(2,4-dichloro-6-phenylphenyl)hexyl] ester IUPAC Name: S-[6-(2,4-dichloro-6-phenylphenyl)hexyl] ethanethioate Traditional Name: ethanethioic acid S-[6-(2,4-dichloro-6-phenyl-phenyl)hexyl] ester Formula: C20H22Cl2OS MolecularWeight: 381.35908

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCCCCCC1=C(C=C(C=C1C2=CC=CC=C2)Cl)Cl

Isomeric SMILES

CC(=O)SCCCCCCC1=C(C=C(C=C1C2=CC=CC=C2)Cl)Cl

InChI

InChI=1S/C20H22Cl2OS/c1-15(23)24-12-8-3-2-7-11-18-19(13-17(21)14-20(18)22)16-9-5-4-6-10-16/h4-6,9-10,13-14H,2-3,7-8,11-12H2,1H3