4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidine

Systemtic Name: 4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidine Openeye Name: 4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidine CAS Name: 4-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidine IUPAC Name: 4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidine Traditional Name: 4-(4-brosylpiperazino)-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidine Formula: C22H20BrF3N4O2S MolecularWeight: 541.38401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C2=CC=C(C=C2)C(F)(F)F)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC(=NC(=N1)C2=CC=C(C=C2)C(F)(F)F)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H20BrF3N4O2S/c1-15-14-20(28-21(27-15)16-2-4-17(5-3-16)22(24,25)26)29-10-12-30(13-11-29)33(31,32)19-8-6-18(23)7-9-19/h2-9,14H,10-13H2,1H3