2-methyl-N-[3-(3-methylphenoxy)propyl]-1,2,4-triazol-3-amine

Systemtic Name: 2-methyl-N-[3-(3-methylphenoxy)propyl]-1,2,4-triazol-3-amine Openeye Name: 2-methyl-N-[3-(3-methylphenoxy)propyl]-1,2,4-triazol-3-amine CAS Name: 2-methyl-N-[3-(3-methylphenoxy)propyl]-1,2,4-triazol-3-amine IUPAC Name: 2-methyl-N-[3-(3-methylphenoxy)propyl]-1,2,4-triazol-3-amine Traditional Name: 3-(3-methylphenoxy)propyl-(2-methyl-1,2,4-triazol-3-yl)amine Formula: C13H18N4O MolecularWeight: 246.30822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCNC2=NC=NN2C

Isomeric SMILES

CC1=CC(=CC=C1)OCCCNC2=NC=NN2C

InChI

InChI=1S/C13H18N4O/c1-11-5-3-6-12(9-11)18-8-4-7-14-13-15-10-16-17(13)2/h3,5-6,9-10H,4,7-8H2,1-2H3,(H,14,15,16)