(3S)-3-[[5-(4-bromophenyl)-1H-imidazol-2-yl]sulfanyl]butan-2-one

Systemtic Name: (3S)-3-[[5-(4-bromophenyl)-1H-imidazol-2-yl]sulfanyl]butan-2-one Openeye Name: (3S)-3-[[5-(4-bromophenyl)-1H-imidazol-2-yl]sulfanyl]butan-2-one CAS Name: (3S)-3-[[5-(4-bromophenyl)-1H-imidazol-2-yl]thio]-2-butanone IUPAC Name: (3S)-3-[[5-(4-bromophenyl)-1H-imidazol-2-yl]sulfanyl]butan-2-one Traditional Name: (3S)-3-[[5-(4-bromophenyl)-1H-imidazol-2-yl]thio]butan-2-one Formula: C13H13BrN2OS MolecularWeight: 325.22412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C)SC1=NC=C(N1)C2=CC=C(C=C2)Br

Isomeric SMILES

C[C@@H](C(=O)C)SC1=NC=C(N1)C2=CC=C(C=C2)Br

InChI

InChI=1S/C13H13BrN2OS/c1-8(17)9(2)18-13-15-7-12(16-13)10-3-5-11(14)6-4-10/h3-7,9H,1-2H3,(H,15,16)/t9-/m0/s1