2-[5-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl]ethanamine

Systemtic Name: 2-[5-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl]ethanamine Openeye Name: 2-[5-(m-tolylmethyl)-1H-1,2,4-triazol-3-yl]ethanamine CAS Name: 2-[5-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl]ethanamine IUPAC Name: 2-[5-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl]ethanamine Traditional Name: 2-[5-(3-methylbenzyl)-1H-1,2,4-triazol-3-yl]ethylamine Formula: C12H16N4 MolecularWeight: 216.28224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2=NC(=NN2)CCN

Isomeric SMILES

CC1=CC(=CC=C1)CC2=NC(=NN2)CCN

InChI

InChI=1S/C12H16N4/c1-9-3-2-4-10(7-9)8-12-14-11(5-6-13)15-16-12/h2-4,7H,5-6,8,13H2,1H3,(H,14,15,16)