5-ethyl-6-methyl-2-[[1-[2-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]amino]-1H-pyrimidin-4-one

Systemtic Name: 5-ethyl-6-methyl-2-[[1-[2-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]amino]-1H-pyrimidin-4-one Openeye Name: 5-ethyl-6-methyl-2-[[1-[2-(trifluoromethyl)phenyl]sulfonyl-4-piperidyl]amino]-1H-pyrimidin-4-one CAS Name: 5-ethyl-6-methyl-2-[[1-[2-(trifluoromethyl)phenyl]sulfonyl-4-piperidinyl]amino]-1H-pyrimidin-4-one IUPAC Name: 5-ethyl-6-methyl-2-[[1-[2-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]amino]-1H-pyrimidin-4-one Traditional Name: 5-ethyl-6-methyl-2-[[1-[2-(trifluoromethyl)phenyl]sulfonyl-4-piperidyl]amino]-1H-pyrimidin-4-one Formula: C19H23F3N4O3S MolecularWeight: 444.47113

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)NC2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(F)(F)F)C

Isomeric SMILES

CCC1=C(NC(=NC1=O)NC2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(F)(F)F)C

InChI

InChI=1S/C19H23F3N4O3S/c1-3-14-12(2)23-18(25-17(14)27)24-13-8-10-26(11-9-13)30(28,29)16-7-5-4-6-15(16)19(20,21)22/h4-7,13H,3,8-11H2,1-2H3,(H2,23,24,25,27)