S-[5-(2,4-dichlorophenyl)sulfanylpentyl] ethanethioate

Systemtic Name: S-[5-(2,4-dichlorophenyl)sulfanylpentyl] ethanethioate Openeye Name: S-[5-(2,4-dichlorophenyl)sulfanylpentyl] ethanethioate CAS Name: ethanethioic acid S-[5-[(2,4-dichlorophenyl)thio]pentyl] ester IUPAC Name: S-[5-(2,4-dichlorophenyl)sulfanylpentyl] ethanethioate Traditional Name: ethanethioic acid S-[5-[(2,4-dichlorophenyl)thio]pentyl] ester Formula: C13H16Cl2OS2 MolecularWeight: 323.30154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCCCCSC1=C(C=C(C=C1)Cl)Cl

Isomeric SMILES

CC(=O)SCCCCCSC1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C13H16Cl2OS2/c1-10(16)17-7-3-2-4-8-18-13-6-5-11(14)9-12(13)15/h5-6,9H,2-4,7-8H2,1H3