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

Systemtic Name: 1-[1-(2-methyl-1,2-dihydropyridin-4-yl)-5-propyl-1,2,4-triazol-3-yl]-2-phenyl-ethanone Openeye Name: 1-[1-(2-methyl-1,2-dihydropyridin-4-yl)-5-propyl-1,2,4-triazol-3-yl]-2-phenyl-ethanone CAS Name: 1-[1-(2-methyl-1,2-dihydropyridin-4-yl)-5-propyl-1,2,4-triazol-3-yl]-2-phenylethanone IUPAC Name: 1-[1-(2-methyl-1,2-dihydropyridin-4-yl)-5-propyl-1,2,4-triazol-3-yl]-2-phenylethanone Traditional Name: 1-[1-(2-methyl-1,2-dihydropyridin-4-yl)-5-propyl-1,2,4-triazol-3-yl]-2-phenyl-ethanone Formula: C19H22N4O MolecularWeight: 322.40418

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1C2=CC(NC=C2)C)C(=O)CC3=CC=CC=C3

Isomeric SMILES

CCCC1=NC(=NN1C2=CC(NC=C2)C)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C19H22N4O/c1-3-7-18-21-19(17(24)13-15-8-5-4-6-9-15)22-23(18)16-10-11-20-14(2)12-16/h4-6,8-12,14,20H,3,7,13H2,1-2H3