5-methyl-2-phenethyl-6-(phenylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 5-methyl-2-phenethyl-6-(phenylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Openeye Name: 6-benzyl-5-methyl-2-phenethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one CAS Name: 5-methyl-2-phenethyl-6-(phenylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one IUPAC Name: 6-benzyl-5-methyl-2-phenethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Traditional Name: 6-benzyl-5-methyl-2-phenethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Formula: C21H20N4O MolecularWeight: 344.4097

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N2C(=N1)N=C(N2)CCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)N2C(=N1)N=C(N2)CCC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C21H20N4O/c1-15-18(14-17-10-6-3-7-11-17)20(26)25-21(22-15)23-19(24-25)13-12-16-8-4-2-5-9-16/h2-11H,12-14H2,1H3,(H,22,23,24)