1-(4-bromophenyl)sulfanyl-4-propan-2-yloxy-butan-2-one

Systemtic Name: 1-(4-bromophenyl)sulfanyl-4-propan-2-yloxy-butan-2-one Openeye Name: 1-(4-bromophenyl)sulfanyl-4-isopropoxy-butan-2-one CAS Name: 1-[(4-bromophenyl)thio]-4-propan-2-yloxy-2-butanone IUPAC Name: 1-(4-bromophenyl)sulfanyl-4-propan-2-yloxybutan-2-one Traditional Name: 1-[(4-bromophenyl)thio]-4-isopropoxy-butan-2-one Formula: C13H17BrO2S MolecularWeight: 317.24188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCC(=O)CSC1=CC=C(C=C1)Br

Isomeric SMILES

CC(C)OCCC(=O)CSC1=CC=C(C=C1)Br

InChI

InChI=1S/C13H17BrO2S/c1-10(2)16-8-7-12(15)9-17-13-5-3-11(14)4-6-13/h3-6,10H,7-9H2,1-2H3