4,6-dimethyl-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]pyrimidine

Systemtic Name: 4,6-dimethyl-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]pyrimidine Openeye Name: 4,6-dimethyl-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]pyrimidine CAS Name: 4,6-dimethyl-2-[4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]pyrimidine IUPAC Name: 4,6-dimethyl-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]pyrimidine Traditional Name: 4,6-dimethyl-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazino]pyrimidine Formula: C17H19F3N4O2S MolecularWeight: 400.41857

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19F3N4O2S/c1-12-10-13(2)22-16(21-12)23-6-8-24(9-7-23)27(25,26)15-5-3-4-14(11-15)17(18,19)20/h3-5,10-11H,6-9H2,1-2H3