4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-1-(2-methylpiperidin-1-yl)butan-1-one

Systemtic Name: 4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-1-(2-methylpiperidin-1-yl)butan-1-one Openeye Name: 4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-1-(2-methyl-1-piperidyl)butan-1-one CAS Name: 4-[[4-(2-methoxyphenyl)-6-(trifluoromethyl)-2-pyrimidinyl]sulfonyl]-1-(2-methyl-1-piperidinyl)-1-butanone IUPAC Name: 4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-1-(2-methylpiperidin-1-yl)butan-1-one Traditional Name: 4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-1-(2-methylpiperidino)butan-1-one Formula: C22H26F3N3O4S MolecularWeight: 485.51975

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CCCS(=O)(=O)C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CC=C3OC

Isomeric SMILES

CC1CCCCN1C(=O)CCCS(=O)(=O)C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CC=C3OC

InChI

InChI=1S/C22H26F3N3O4S/c1-15-8-5-6-12-28(15)20(29)11-7-13-33(30,31)21-26-17(14-19(27-21)22(23,24)25)16-9-3-4-10-18(16)32-2/h3-4,9-10,14-15H,5-8,11-13H2,1-2H3