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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC(=N1)C(=O)CC2CCCCC2)C3=C(CNC=C3)C

Isomeric SMILES

CCCCN1C(=NC(=N1)C(=O)CC2CCCCC2)C3=C(CNC=C3)C

InChI

InChI=1S/C20H30N4O/c1-3-4-12-24-20(17-10-11-21-14-15(17)2)22-19(23-24)18(25)13-16-8-6-5-7-9-16/h10-11,16,21H,3-9,12-14H2,1-2H3