1-(4-azanyl-2,3,5-trimethyl-phenyl)-2-(1,2,3-triazol-1-yl)ethanone

Systemtic Name: 1-(4-azanyl-2,3,5-trimethyl-phenyl)-2-(1,2,3-triazol-1-yl)ethanone Openeye Name: 1-(4-amino-2,3,5-trimethyl-phenyl)-2-(triazol-1-yl)ethanone CAS Name: 1-(4-amino-2,3,5-trimethylphenyl)-2-(1-triazolyl)ethanone IUPAC Name: 1-(4-amino-2,3,5-trimethylphenyl)-2-(triazol-1-yl)ethanone Traditional Name: 1-(4-amino-2,3,5-trimethyl-phenyl)-2-(triazol-1-yl)ethanone Formula: C13H16N4O MolecularWeight: 244.29234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1)C(=O)CN2C=CN=N2)C)C)N

Isomeric SMILES

CC1=C(C(=C(C(=C1)C(=O)CN2C=CN=N2)C)C)N

InChI

InChI=1S/C13H16N4O/c1-8-6-11(9(2)10(3)13(8)14)12(18)7-17-5-4-15-16-17/h4-6H,7,14H2,1-3H3