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

Systemtic Name: 4-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-methyl-6-(4-methylpiperazin-1-yl)pyrimidine Openeye Name: 4-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-methyl-6-(4-methylpiperazin-1-yl)pyrimidine CAS Name: 4-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-2-methyl-6-(4-methyl-1-piperazinyl)pyrimidine IUPAC Name: 4-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-methyl-6-(4-methylpiperazin-1-yl)pyrimidine Traditional Name: 4-[4-(3-fluorophenyl)sulfonylpiperazino]-2-methyl-6-(4-methylpiperazino)pyrimidine Formula: C20H27FN6O2S MolecularWeight: 434.530783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F)N4CCN(CC4)C

Isomeric SMILES

CC1=NC(=CC(=N1)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F)N4CCN(CC4)C

InChI

InChI=1S/C20H27FN6O2S/c1-16-22-19(25-8-6-24(2)7-9-25)15-20(23-16)26-10-12-27(13-11-26)30(28,29)18-5-3-4-17(21)14-18/h3-5,14-15H,6-13H2,1-2H3