3-[(3,4-dimethylphenyl)amino]-6-(furan-2-ylmethyl)-2H-1,2,4-triazin-5-one

Systemtic Name: 3-[(3,4-dimethylphenyl)amino]-6-(furan-2-ylmethyl)-2H-1,2,4-triazin-5-one Openeye Name: 3-(3,4-dimethylanilino)-6-(2-furylmethyl)-2H-1,2,4-triazin-5-one CAS Name: 3-(3,4-dimethylanilino)-6-(2-furanylmethyl)-2H-1,2,4-triazin-5-one IUPAC Name: 3-(3,4-dimethylanilino)-6-(furan-2-ylmethyl)-2H-1,2,4-triazin-5-one Traditional Name: 3-(3,4-dimethylanilino)-6-(2-furfuryl)-2H-1,2,4-triazin-5-one Formula: C16H16N4O2 MolecularWeight: 296.32384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC(=O)C(=NN2)CC3=CC=CO3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC(=O)C(=NN2)CC3=CC=CO3)C

InChI

InChI=1S/C16H16N4O2/c1-10-5-6-12(8-11(10)2)17-16-18-15(21)14(19-20-16)9-13-4-3-7-22-13/h3-8H,9H2,1-2H3,(H2,17,18,20,21)