3-(1,3-benzodioxol-5-ylmethylamino)-6-(4-fluorophenyl)-2H-1,2,4-triazin-5-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylamino)-6-(4-fluorophenyl)-2H-1,2,4-triazin-5-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethylamino)-6-(4-fluorophenyl)-2H-1,2,4-triazin-5-one CAS Name: 3-(1,3-benzodioxol-5-ylmethylamino)-6-(4-fluorophenyl)-2H-1,2,4-triazin-5-one IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylamino)-6-(4-fluorophenyl)-2H-1,2,4-triazin-5-one Traditional Name: 6-(4-fluorophenyl)-3-(piperonylamino)-2H-1,2,4-triazin-5-one Formula: C17H13FN4O3 MolecularWeight: 340.308523

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=O)C(=NN3)C4=CC=C(C=C4)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=O)C(=NN3)C4=CC=C(C=C4)F

InChI

InChI=1S/C17H13FN4O3/c18-12-4-2-11(3-5-12)15-16(23)20-17(22-21-15)19-8-10-1-6-13-14(7-10)25-9-24-13/h1-7H,8-9H2,(H2,19,20,22,23)