N-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-6-(4-methylpiperidin-1-yl)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-6-(4-methylpiperidin-1-yl)-5-nitro-pyrimidin-4-amine Openeye Name: N-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-6-(4-methyl-1-piperidyl)-5-nitro-pyrimidin-4-amine CAS Name: N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-6-(4-methyl-1-piperidinyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-6-(4-methylpiperidin-1-yl)-5-nitropyrimidin-4-amine Traditional Name: [3-chloro-5-(trifluoromethyl)-2-pyridyl]-[6-(4-methylpiperidino)-5-nitro-pyrimidin-4-yl]amine Formula: C16H16ClF3N6O2 MolecularWeight: 416.78545

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C(=NC=N2)NC3=C(C=C(C=N3)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C(=NC=N2)NC3=C(C=C(C=N3)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H16ClF3N6O2/c1-9-2-4-25(5-3-9)15-12(26(27)28)14(22-8-23-15)24-13-11(17)6-10(7-21-13)16(18,19)20/h6-9H,2-5H2,1H3,(H,21,22,23,24)