N-[3-oxidanyl-1-[2-(pyrimidin-2-ylamino)ethyl]piperidin-4-yl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[3-oxidanyl-1-[2-(pyrimidin-2-ylamino)ethyl]piperidin-4-yl]-3-(trifluoromethyl)benzamide Openeye Name: N-[3-hydroxy-1-[2-(pyrimidin-2-ylamino)ethyl]-4-piperidyl]-3-(trifluoromethyl)benzamide CAS Name: N-[3-hydroxy-1-[2-(2-pyrimidinylamino)ethyl]-4-piperidinyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[3-hydroxy-1-[2-(pyrimidin-2-ylamino)ethyl]piperidin-4-yl]-3-(trifluoromethyl)benzamide Traditional Name: N-[3-hydroxy-1-[2-(2-pyrimidylamino)ethyl]-4-piperidyl]-3-(trifluoromethyl)benzamide Formula: C19H22F3N5O2 MolecularWeight: 409.40549

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1NC(=O)C2=CC(=CC=C2)C(F)(F)F)O)CCNC3=NC=CC=N3

Isomeric SMILES

C1CN(CC(C1NC(=O)C2=CC(=CC=C2)C(F)(F)F)O)CCNC3=NC=CC=N3

InChI

InChI=1S/C19H22F3N5O2/c20-19(21,22)14-4-1-3-13(11-14)17(29)26-15-5-9-27(12-16(15)28)10-8-25-18-23-6-2-7-24-18/h1-4,6-7,11,15-16,28H,5,8-10,12H2,(H,26,29)(H,23,24,25)