N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine

Systemtic Name: N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine Openeye Name: N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine CAS Name: N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine IUPAC Name: N-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine Traditional Name: (3,4-diethoxybenzyl)-(1H-1,2,4-triazol-5-yl)amine Formula: C13H18N4O2 MolecularWeight: 262.30762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC2=NC=NN2)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC2=NC=NN2)OCC

InChI

InChI=1S/C13H18N4O2/c1-3-18-11-6-5-10(7-12(11)19-4-2)8-14-13-15-9-16-17-13/h5-7,9H,3-4,8H2,1-2H3,(H2,14,15,16,17)