5-[2-(4-methoxyphenyl)ethyl]-2-[(4-methylphenyl)methyl]-4-propyl-1,2,4-triazol-3-one

Systemtic Name: 5-[2-(4-methoxyphenyl)ethyl]-2-[(4-methylphenyl)methyl]-4-propyl-1,2,4-triazol-3-one Openeye Name: 5-[2-(4-methoxyphenyl)ethyl]-4-propyl-2-(p-tolylmethyl)-1,2,4-triazol-3-one CAS Name: 5-[2-(4-methoxyphenyl)ethyl]-2-[(4-methylphenyl)methyl]-4-propyl-1,2,4-triazol-3-one IUPAC Name: 5-[2-(4-methoxyphenyl)ethyl]-2-[(4-methylphenyl)methyl]-4-propyl-1,2,4-triazol-3-one Traditional Name: 5-[2-(4-methoxyphenyl)ethyl]-2-(4-methylbenzyl)-4-propyl-1,2,4-triazol-3-one Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN(C1=O)CC2=CC=C(C=C2)C)CCC3=CC=C(C=C3)OC

Isomeric SMILES

CCCN1C(=NN(C1=O)CC2=CC=C(C=C2)C)CCC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H27N3O2/c1-4-15-24-21(14-11-18-9-12-20(27-3)13-10-18)23-25(22(24)26)16-19-7-5-17(2)6-8-19/h5-10,12-13H,4,11,14-16H2,1-3H3