N4-cyclopropyl-5-nitro-N2-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]pyrimidine-2,4-diamine

Systemtic Name: N4-cyclopropyl-5-nitro-N2-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]pyrimidine-2,4-diamine Openeye Name: N4-cyclopropyl-5-nitro-N2-[1-[5-(trifluoromethyl)-2-pyridyl]-4-piperidyl]pyrimidine-2,4-diamine CAS Name: N4-cyclopropyl-5-nitro-N2-[1-[5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl]pyrimidine-2,4-diamine IUPAC Name: 4-N-cyclopropyl-5-nitro-2-N-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]pyrimidine-2,4-diamine Traditional Name: cyclopropyl-[5-nitro-2-[[1-[5-(trifluoromethyl)-2-pyridyl]-4-piperidyl]amino]pyrimidin-4-yl]amine Formula: C18H20F3N7O2 MolecularWeight: 423.39231

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC(=NC=C2[N+](=O)[O-])NC3CCN(CC3)C4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CC1NC2=NC(=NC=C2[N+](=O)[O-])NC3CCN(CC3)C4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C18H20F3N7O2/c19-18(20,21)11-1-4-15(22-9-11)27-7-5-13(6-8-27)25-17-23-10-14(28(29)30)16(26-17)24-12-2-3-12/h1,4,9-10,12-13H,2-3,5-8H2,(H2,23,24,25,26)