1-[5-butyl-1-(2-methyl-1,2-dihydropyridin-4-yl)-1,2,4-triazol-3-yl]-2-cyclohexyl-ethanone

Systemtic Name: 1-[5-butyl-1-(2-methyl-1,2-dihydropyridin-4-yl)-1,2,4-triazol-3-yl]-2-cyclohexyl-ethanone Openeye Name: 1-[5-butyl-1-(2-methyl-1,2-dihydropyridin-4-yl)-1,2,4-triazol-3-yl]-2-cyclohexyl-ethanone CAS Name: 1-[5-butyl-1-(2-methyl-1,2-dihydropyridin-4-yl)-1,2,4-triazol-3-yl]-2-cyclohexylethanone IUPAC Name: 1-[5-butyl-1-(2-methyl-1,2-dihydropyridin-4-yl)-1,2,4-triazol-3-yl]-2-cyclohexylethanone Traditional Name: 1-[5-butyl-1-(2-methyl-1,2-dihydropyridin-4-yl)-1,2,4-triazol-3-yl]-2-cyclohexyl-ethanone Formula: C20H30N4O MolecularWeight: 342.4784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=NN1C2=CC(NC=C2)C)C(=O)CC3CCCCC3

Isomeric SMILES

CCCCC1=NC(=NN1C2=CC(NC=C2)C)C(=O)CC3CCCCC3

InChI

InChI=1S/C20H30N4O/c1-3-4-10-19-22-20(18(25)14-16-8-6-5-7-9-16)23-24(19)17-11-12-21-15(2)13-17/h11-13,15-16,21H,3-10,14H2,1-2H3