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

Systemtic Name: N-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-6-cyclohexyloxy-5-nitro-pyrimidin-4-amine Openeye Name: N-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-6-(cyclohexoxy)-5-nitro-pyrimidin-4-amine CAS Name: N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-6-cyclohexyloxy-5-nitro-4-pyrimidinamine IUPAC Name: N-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-6-cyclohexyloxy-5-nitropyrimidin-4-amine Traditional Name: [3-chloro-5-(trifluoromethyl)-2-pyridyl]-[6-(cyclohexoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C16H15ClF3N5O3 MolecularWeight: 417.77021

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

C1CCC(CC1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C16H15ClF3N5O3/c17-11-6-9(16(18,19)20)7-21-13(11)24-14-12(25(26)27)15(23-8-22-14)28-10-4-2-1-3-5-10/h6-8,10H,1-5H2,(H,21,22,23,24)