4-[4-bromanyl-5-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]-2-methylsulfonyl-pyrimidine

Systemtic Name: 4-[4-bromanyl-5-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]-2-methylsulfonyl-pyrimidine Openeye Name: 4-[4-bromo-5-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]-2-methylsulfonyl-pyrimidine CAS Name: 4-[4-bromo-5-[3-(trifluoromethyl)phenyl]-1-pyrazolyl]-2-methylsulfonylpyrimidine IUPAC Name: 4-[4-bromo-5-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]-2-methylsulfonylpyrimidine Traditional Name: 4-[4-bromo-5-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]-2-mesyl-pyrimidine Formula: C15H10BrF3N4O2S MolecularWeight: 447.22971

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=CC(=N1)N2C(=C(C=N2)Br)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=NC=CC(=N1)N2C(=C(C=N2)Br)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C15H10BrF3N4O2S/c1-26(24,25)14-20-6-5-12(22-14)23-13(11(16)8-21-23)9-3-2-4-10(7-9)15(17,18)19/h2-8H,1H3