S-[[3-[bis(bromanyl)methyl]-5-(4-bromophenyl)phenyl]methyl] ethanethioate

Systemtic Name: S-[[3-[bis(bromanyl)methyl]-5-(4-bromophenyl)phenyl]methyl] ethanethioate Openeye Name: S-[[3-(4-bromophenyl)-5-(dibromomethyl)phenyl]methyl] ethanethioate CAS Name: ethanethioic acid S-[[3-(4-bromophenyl)-5-(dibromomethyl)phenyl]methyl] ester IUPAC Name: S-[[3-(4-bromophenyl)-5-(dibromomethyl)phenyl]methyl] ethanethioate Traditional Name: ethanethioic acid S-[3-(4-bromophenyl)-5-(dibromomethyl)benzyl] ester Formula: C16H13Br3OS MolecularWeight: 493.05082

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1=CC(=CC(=C1)C2=CC=C(C=C2)Br)C(Br)Br

Isomeric SMILES

CC(=O)SCC1=CC(=CC(=C1)C2=CC=C(C=C2)Br)C(Br)Br

InChI

InChI=1S/C16H13Br3OS/c1-10(20)21-9-11-6-13(8-14(7-11)16(18)19)12-2-4-15(17)5-3-12/h2-8,16H,9H2,1H3