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

Systemtic Name: 5-methyl-2-[(2-methylphenyl)methylamino]-6-(phenylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Openeye Name: 6-benzyl-5-methyl-2-(o-tolylmethylamino)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one CAS Name: 5-methyl-2-[(2-methylphenyl)methylamino]-6-(phenylmethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one IUPAC Name: 6-benzyl-5-methyl-2-[(2-methylphenyl)methylamino]-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Traditional Name: 6-benzyl-5-methyl-2-[(2-methylbenzyl)amino]-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC2=NC3=NC(=C(C(=O)N3N2)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=CC=C1CNC2=NC3=NC(=C(C(=O)N3N2)CC4=CC=CC=C4)C

InChI

InChI=1S/C21H21N5O/c1-14-8-6-7-11-17(14)13-22-20-24-21-23-15(2)18(19(27)26(21)25-20)12-16-9-4-3-5-10-16/h3-11H,12-13H2,1-2H3,(H2,22,23,24,25)