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

Systemtic Name: 2-cyclohexyl-1-[5-(2-methyl-1,2-dihydropyridin-4-yl)-1-pentyl-1,2,4-triazol-3-yl]ethanone Openeye Name: 2-cyclohexyl-1-[5-(2-methyl-1,2-dihydropyridin-4-yl)-1-pentyl-1,2,4-triazol-3-yl]ethanone CAS Name: 2-cyclohexyl-1-[5-(2-methyl-1,2-dihydropyridin-4-yl)-1-pentyl-1,2,4-triazol-3-yl]ethanone IUPAC Name: 2-cyclohexyl-1-[5-(2-methyl-1,2-dihydropyridin-4-yl)-1-pentyl-1,2,4-triazol-3-yl]ethanone Traditional Name: 1-[1-amyl-5-(2-methyl-1,2-dihydropyridin-4-yl)-1,2,4-triazol-3-yl]-2-cyclohexyl-ethanone Formula: C21H32N4O MolecularWeight: 356.50498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=NC(=N1)C(=O)CC2CCCCC2)C3=CC(NC=C3)C

Isomeric SMILES

CCCCCN1C(=NC(=N1)C(=O)CC2CCCCC2)C3=CC(NC=C3)C

InChI

InChI=1S/C21H32N4O/c1-3-4-8-13-25-21(18-11-12-22-16(2)14-18)23-20(24-25)19(26)15-17-9-6-5-7-10-17/h11-12,14,16-17,22H,3-10,13,15H2,1-2H3