5-nitro-6-piperidin-1-yl-N-[3-(trifluoromethyl)phenyl]pyrimidin-4-amine

Systemtic Name: 5-nitro-6-piperidin-1-yl-N-[3-(trifluoromethyl)phenyl]pyrimidin-4-amine Openeye Name: 5-nitro-6-(1-piperidyl)-N-[3-(trifluoromethyl)phenyl]pyrimidin-4-amine CAS Name: 5-nitro-6-(1-piperidinyl)-N-[3-(trifluoromethyl)phenyl]-4-pyrimidinamine IUPAC Name: 5-nitro-6-piperidin-1-yl-N-[3-(trifluoromethyl)phenyl]pyrimidin-4-amine Traditional Name: (5-nitro-6-piperidino-pyrimidin-4-yl)-[3-(trifluoromethyl)phenyl]amine Formula: C16H16F3N5O2 MolecularWeight: 367.32575

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=NC=N2)NC3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C(=NC=N2)NC3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H16F3N5O2/c17-16(18,19)11-5-4-6-12(9-11)22-14-13(24(25)26)15(21-10-20-14)23-7-2-1-3-8-23/h4-6,9-10H,1-3,7-8H2,(H,20,21,22)