4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-(3-fluorophenyl)-6-methyl-pyrimidine

Systemtic Name: 4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-(3-fluorophenyl)-6-methyl-pyrimidine Openeye Name: 4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-(3-fluorophenyl)-6-methyl-pyrimidine CAS Name: 4-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-2-(3-fluorophenyl)-6-methylpyrimidine IUPAC Name: 4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-(3-fluorophenyl)-6-methylpyrimidine Traditional Name: 4-(4-brosylpiperazino)-2-(3-fluorophenyl)-6-methyl-pyrimidine Formula: C21H20BrFN4O2S MolecularWeight: 491.376503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20BrFN4O2S/c1-15-13-20(25-21(24-15)16-3-2-4-18(23)14-16)26-9-11-27(12-10-26)30(28,29)19-7-5-17(22)6-8-19/h2-8,13-14H,9-12H2,1H3