4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-6-methyl-2-(4-methylphenyl)-5-propan-2-yl-pyrimidine

Systemtic Name: 4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-6-methyl-2-(4-methylphenyl)-5-propan-2-yl-pyrimidine Openeye Name: 4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-5-isopropyl-6-methyl-2-(p-tolyl)pyrimidine CAS Name: 4-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-6-methyl-2-(4-methylphenyl)-5-propan-2-ylpyrimidine IUPAC Name: 4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-6-methyl-2-(4-methylphenyl)-5-propan-2-ylpyrimidine Traditional Name: 4-(4-brosylpiperazino)-5-isopropyl-6-methyl-2-(p-tolyl)pyrimidine Formula: C25H29BrN4O2S MolecularWeight: 529.49236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br)C(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br)C(C)C)C

InChI

InChI=1S/C25H29BrN4O2S/c1-17(2)23-19(4)27-24(20-7-5-18(3)6-8-20)28-25(23)29-13-15-30(16-14-29)33(31,32)22-11-9-21(26)10-12-22/h5-12,17H,13-16H2,1-4H3