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

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylamino)-6-[(4-fluorophenyl)methyl]-2H-1,2,4-triazin-5-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethylamino)-6-[(4-fluorophenyl)methyl]-2H-1,2,4-triazin-5-one CAS Name: 3-(1,3-benzodioxol-5-ylmethylamino)-6-[(4-fluorophenyl)methyl]-2H-1,2,4-triazin-5-one IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylamino)-6-[(4-fluorophenyl)methyl]-2H-1,2,4-triazin-5-one Traditional Name: 6-(4-fluorobenzyl)-3-(piperonylamino)-2H-1,2,4-triazin-5-one Formula: C18H15FN4O3 MolecularWeight: 354.335103

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=O)C(=NN3)CC4=CC=C(C=C4)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=O)C(=NN3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C18H15FN4O3/c19-13-4-1-11(2-5-13)7-14-17(24)21-18(23-22-14)20-9-12-3-6-15-16(8-12)26-10-25-15/h1-6,8H,7,9-10H2,(H2,20,21,23,24)