1-[5-azanyl-2-(4-methylphenyl)-1,2,3-triazol-4-yl]propan-1-one

Systemtic Name: 1-[5-azanyl-2-(4-methylphenyl)-1,2,3-triazol-4-yl]propan-1-one Openeye Name: 1-[5-amino-2-(p-tolyl)triazol-4-yl]propan-1-one CAS Name: 1-[5-amino-2-(4-methylphenyl)-4-triazolyl]-1-propanone IUPAC Name: 1-[5-amino-2-(4-methylphenyl)triazol-4-yl]propan-1-one Traditional Name: 1-[5-amino-2-(p-tolyl)triazol-4-yl]propan-1-one Formula: C12H14N4O MolecularWeight: 230.26576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=NN(N=C1N)C2=CC=C(C=C2)C

Isomeric SMILES

CCC(=O)C1=NN(N=C1N)C2=CC=C(C=C2)C

InChI

InChI=1S/C12H14N4O/c1-3-10(17)11-12(13)15-16(14-11)9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3,(H2,13,15)