1-(4-bromophenyl)-2-[6-methyl-5-[(1S)-1-oxidanylethyl]-2-phenyl-pyrimidin-4-yl]sulfanyl-ethanone

Systemtic Name: 1-(4-bromophenyl)-2-[6-methyl-5-[(1S)-1-oxidanylethyl]-2-phenyl-pyrimidin-4-yl]sulfanyl-ethanone Openeye Name: 1-(4-bromophenyl)-2-[5-[(1S)-1-hydroxyethyl]-6-methyl-2-phenyl-pyrimidin-4-yl]sulfanyl-ethanone CAS Name: 1-(4-bromophenyl)-2-[[5-[(1S)-1-hydroxyethyl]-6-methyl-2-phenyl-4-pyrimidinyl]thio]ethanone IUPAC Name: 1-(4-bromophenyl)-2-[5-[(1S)-1-hydroxyethyl]-6-methyl-2-phenylpyrimidin-4-yl]sulfanylethanone Traditional Name: 1-(4-bromophenyl)-2-[[5-[(1S)-1-hydroxyethyl]-6-methyl-2-phenyl-pyrimidin-4-yl]thio]ethanone Formula: C21H19BrN2O2S MolecularWeight: 443.35676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CC=C2)SCC(=O)C3=CC=C(C=C3)Br)C(C)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CC=C2)SCC(=O)C3=CC=C(C=C3)Br)[C@H](C)O

InChI

InChI=1S/C21H19BrN2O2S/c1-13-19(14(2)25)21(24-20(23-13)16-6-4-3-5-7-16)27-12-18(26)15-8-10-17(22)11-9-15/h3-11,14,25H,12H2,1-2H3/t14-/m0/s1