(2S)-1-(5-bromanyl-2-oxidanyl-phenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-propan-1-one

Systemtic Name: (2S)-1-(5-bromanyl-2-oxidanyl-phenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-propan-1-one Openeye Name: (2S)-1-(5-bromo-2-hydroxy-phenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-propan-1-one CAS Name: (2S)-1-(5-bromo-2-hydroxyphenyl)-2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-propanone IUPAC Name: (2S)-1-(5-bromo-2-hydroxyphenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanylpropan-1-one Traditional Name: (2S)-1-(5-bromo-2-hydroxy-phenyl)-2-[(4,6-dimethylpyrimidin-2-yl)thio]propan-1-one Formula: C15H15BrN2O2S MolecularWeight: 367.2608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC(C)C(=O)C2=C(C=CC(=C2)Br)O)C

Isomeric SMILES

CC1=CC(=NC(=N1)S[C@@H](C)C(=O)C2=C(C=CC(=C2)Br)O)C

InChI

InChI=1S/C15H15BrN2O2S/c1-8-6-9(2)18-15(17-8)21-10(3)14(20)12-7-11(16)4-5-13(12)19/h4-7,10,19H,1-3H3/t10-/m0/s1