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

Systemtic Name: 3-(1,3-benzodioxol-5-ylamino)-6-(4-fluorophenyl)-2H-1,2,4-triazin-5-one Openeye Name: 3-(1,3-benzodioxol-5-ylamino)-6-(4-fluorophenyl)-2H-1,2,4-triazin-5-one CAS Name: 3-(1,3-benzodioxol-5-ylamino)-6-(4-fluorophenyl)-2H-1,2,4-triazin-5-one IUPAC Name: 3-(1,3-benzodioxol-5-ylamino)-6-(4-fluorophenyl)-2H-1,2,4-triazin-5-one Traditional Name: 3-(1,3-benzodioxol-5-ylamino)-6-(4-fluorophenyl)-2H-1,2,4-triazin-5-one Formula: C16H11FN4O3 MolecularWeight: 326.281943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC3=NC(=O)C(=NN3)C4=CC=C(C=C4)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC3=NC(=O)C(=NN3)C4=CC=C(C=C4)F

InChI

InChI=1S/C16H11FN4O3/c17-10-3-1-9(2-4-10)14-15(22)19-16(21-20-14)18-11-5-6-12-13(7-11)24-8-23-12/h1-7H,8H2,(H2,18,19,21,22)