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

Systemtic Name: (3-azanyl-1,2,4-triazol-1-yl)-(4-heptylphenyl)methanone Openeye Name: (3-amino-1,2,4-triazol-1-yl)-(4-heptylphenyl)methanone CAS Name: (3-amino-1,2,4-triazol-1-yl)-(4-heptylphenyl)methanone IUPAC Name: (3-amino-1,2,4-triazol-1-yl)-(4-heptylphenyl)methanone Traditional Name: (3-amino-1,2,4-triazol-1-yl)-(4-heptylphenyl)methanone Formula: C16H22N4O MolecularWeight: 286.37208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C(=O)N2C=NC(=N2)N

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C(=O)N2C=NC(=N2)N

InChI

InChI=1S/C16H22N4O/c1-2-3-4-5-6-7-13-8-10-14(11-9-13)15(21)20-12-18-16(17)19-20/h8-12H,2-7H2,1H3,(H2,17,19)