4-[4-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-6-methyl-2-propan-2-yl-pyrimidine

Systemtic Name: 4-[4-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-6-methyl-2-propan-2-yl-pyrimidine Openeye Name: 4-[4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-2-isopropyl-6-methyl-pyrimidine CAS Name: 4-[4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]-6-methyl-2-propan-2-ylpyrimidine IUPAC Name: 4-[4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-6-methyl-2-propan-2-ylpyrimidine Traditional Name: 4-[4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperazino]-2-isopropyl-6-methyl-pyrimidine Formula: C19H22ClF3N4O2S MolecularWeight: 462.91679

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22ClF3N4O2S/c1-12(2)18-24-13(3)10-17(25-18)26-6-8-27(9-7-26)30(28,29)14-4-5-16(20)15(11-14)19(21,22)23/h4-5,10-12H,6-9H2,1-3H3