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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(=NC(=N1)C2=CC=C(C=C2)C)N

Isomeric SMILES

CCC(=O)N1C(=NC(=N1)C2=CC=C(C=C2)C)N

InChI

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