(2R)-1-(4-bromophenyl)-2-(1-methylimidazol-2-yl)sulfanyl-propan-1-one

Systemtic Name: (2R)-1-(4-bromophenyl)-2-(1-methylimidazol-2-yl)sulfanyl-propan-1-one Openeye Name: (2R)-1-(4-bromophenyl)-2-(1-methylimidazol-2-yl)sulfanyl-propan-1-one CAS Name: (2R)-1-(4-bromophenyl)-2-[(1-methyl-2-imidazolyl)thio]-1-propanone IUPAC Name: (2R)-1-(4-bromophenyl)-2-(1-methylimidazol-2-yl)sulfanylpropan-1-one Traditional Name: (2R)-1-(4-bromophenyl)-2-[(1-methylimidazol-2-yl)thio]propan-1-one Formula: C13H13BrN2OS MolecularWeight: 325.22412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)Br)SC2=NC=CN2C

Isomeric SMILES

C[C@H](C(=O)C1=CC=C(C=C1)Br)SC2=NC=CN2C

InChI

InChI=1S/C13H13BrN2OS/c1-9(18-13-15-7-8-16(13)2)12(17)10-3-5-11(14)6-4-10/h3-9H,1-2H3/t9-/m1/s1