(3-azanyl-1,2,4-triazol-4-yl)-(4-tert-butylphenyl)methanone

Systemtic Name: (3-azanyl-1,2,4-triazol-4-yl)-(4-tert-butylphenyl)methanone Openeye Name: (3-amino-1,2,4-triazol-4-yl)-(4-tert-butylphenyl)methanone CAS Name: (3-amino-1,2,4-triazol-4-yl)-(4-tert-butylphenyl)methanone IUPAC Name: (3-amino-1,2,4-triazol-4-yl)-(4-tert-butylphenyl)methanone Traditional Name: (3-amino-1,2,4-triazol-4-yl)-(4-tert-butylphenyl)methanone Formula: C13H16N4O MolecularWeight: 244.29234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2C=NN=C2N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2C=NN=C2N

InChI

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