5-fluoranyl-4-morpholin-4-yl-N-[(E)-(5-nitro-2-pyrrolidin-1-yl-phenyl)methylideneamino]pyrimidin-2-amine

Systemtic Name: 5-fluoranyl-4-morpholin-4-yl-N-[(E)-(5-nitro-2-pyrrolidin-1-yl-phenyl)methylideneamino]pyrimidin-2-amine Openeye Name: 5-fluoro-4-morpholino-N-[(E)-(5-nitro-2-pyrrolidin-1-yl-phenyl)methyleneamino]pyrimidin-2-amine CAS Name: 5-fluoro-4-(4-morpholinyl)-N-[(E)-[5-nitro-2-(1-pyrrolidinyl)phenyl]methylideneamino]-2-pyrimidinamine IUPAC Name: 5-fluoro-4-morpholin-4-yl-N-[(E)-(5-nitro-2-pyrrolidin-1-ylphenyl)methylideneamino]pyrimidin-2-amine Traditional Name: (5-fluoro-4-morpholino-pyrimidin-2-yl)-[(E)-(5-nitro-2-pyrrolidino-benzylidene)amino]amine Formula: C19H22FN7O3 MolecularWeight: 415.421483

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C=NNC3=NC=C(C(=N3)N4CCOCC4)F

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])/C=N/NC3=NC=C(C(=N3)N4CCOCC4)F

InChI

InChI=1S/C19H22FN7O3/c20-16-13-21-19(23-18(16)26-7-9-30-10-8-26)24-22-12-14-11-15(27(28)29)3-4-17(14)25-5-1-2-6-25/h3-4,11-13H,1-2,5-10H2,(H,21,23,24)/b22-12+