N-(4-methylphenyl)sulfonyl-4-[[4-(trifluoromethyl)pyrimidin-2-yl]amino]piperidine-1-carboxamide

Systemtic Name: N-(4-methylphenyl)sulfonyl-4-[[4-(trifluoromethyl)pyrimidin-2-yl]amino]piperidine-1-carboxamide Openeye Name: N-(p-tolylsulfonyl)-4-[[4-(trifluoromethyl)pyrimidin-2-yl]amino]piperidine-1-carboxamide CAS Name: N-(4-methylphenyl)sulfonyl-4-[[4-(trifluoromethyl)-2-pyrimidinyl]amino]-1-piperidinecarboxamide IUPAC Name: N-(4-methylphenyl)sulfonyl-4-[[4-(trifluoromethyl)pyrimidin-2-yl]amino]piperidine-1-carboxamide Traditional Name: N-tosyl-4-[[4-(trifluoromethyl)pyrimidin-2-yl]amino]piperidine-1-carboxamide Formula: C18H20F3N5O3S MolecularWeight: 443.44331

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N2CCC(CC2)NC3=NC=CC(=N3)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N2CCC(CC2)NC3=NC=CC(=N3)C(F)(F)F

InChI

InChI=1S/C18H20F3N5O3S/c1-12-2-4-14(5-3-12)30(28,29)25-17(27)26-10-7-13(8-11-26)23-16-22-9-6-15(24-16)18(19,20)21/h2-6,9,13H,7-8,10-11H2,1H3,(H,25,27)(H,22,23,24)