N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-5-fluoranyl-4-morpholin-4-yl-pyrimidin-2-amine

Systemtic Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-5-fluoranyl-4-morpholin-4-yl-pyrimidin-2-amine Openeye Name: N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-5-fluoro-4-morpholino-pyrimidin-2-amine CAS Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-5-fluoro-4-(4-morpholinyl)-2-pyrimidinamine IUPAC Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-5-fluoro-4-morpholin-4-ylpyrimidin-2-amine Traditional Name: (5-fluoro-4-morpholino-pyrimidin-2-yl)-[(E)-piperonylideneamino]amine Formula: C16H16FN5O3 MolecularWeight: 345.328343

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=NC=C2F)NN=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1COCCN1C2=NC(=NC=C2F)N/N=C/C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C16H16FN5O3/c17-12-9-18-16(20-15(12)22-3-5-23-6-4-22)21-19-8-11-1-2-13-14(7-11)25-10-24-13/h1-2,7-9H,3-6,10H2,(H,18,20,21)/b19-8+