1-(5-azanyl-3-phenyl-1,2,4-triazol-1-yl)propan-1-one

Systemtic Name: 1-(5-azanyl-3-phenyl-1,2,4-triazol-1-yl)propan-1-one Openeye Name: 1-(5-amino-3-phenyl-1,2,4-triazol-1-yl)propan-1-one CAS Name: 1-(5-amino-3-phenyl-1,2,4-triazol-1-yl)-1-propanone IUPAC Name: 1-(5-amino-3-phenyl-1,2,4-triazol-1-yl)propan-1-one Traditional Name: 1-(5-amino-3-phenyl-1,2,4-triazol-1-yl)propan-1-one Formula: C11H12N4O MolecularWeight: 216.23918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N4O/c1-2-9(16)15-11(12)13-10(14-15)8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H2,12,13,14)