N-[2-chloranyl-5-(trifluoromethyl)phenyl]-6-morpholin-4-yl-5-nitro-pyrimidin-4-amine

Systemtic Name: N-[2-chloranyl-5-(trifluoromethyl)phenyl]-6-morpholin-4-yl-5-nitro-pyrimidin-4-amine Openeye Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-6-morpholino-5-nitro-pyrimidin-4-amine CAS Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-6-(4-morpholinyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-6-morpholin-4-yl-5-nitropyrimidin-4-amine Traditional Name: [2-chloro-5-(trifluoromethyl)phenyl]-(6-morpholino-5-nitro-pyrimidin-4-yl)amine Formula: C15H13ClF3N5O3 MolecularWeight: 403.74363

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C(=NC=N2)NC3=C(C=CC(=C3)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C(=NC=N2)NC3=C(C=CC(=C3)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H13ClF3N5O3/c16-10-2-1-9(15(17,18)19)7-11(10)22-13-12(24(25)26)14(21-8-20-13)23-3-5-27-6-4-23/h1-2,7-8H,3-6H2,(H,20,21,22)