7-(2-methylpropyl)-5-(phenylmethyl)-4-(4-pyridin-2-ylpiperazin-1-yl)-7,8-dihydropteridin-6-one

Systemtic Name: 7-(2-methylpropyl)-5-(phenylmethyl)-4-(4-pyridin-2-ylpiperazin-1-yl)-7,8-dihydropteridin-6-one Openeye Name: 5-benzyl-7-isobutyl-4-[4-(2-pyridyl)piperazin-1-yl]-7,8-dihydropteridin-6-one CAS Name: 7-(2-methylpropyl)-5-(phenylmethyl)-4-[4-(2-pyridinyl)-1-piperazinyl]-7,8-dihydropteridin-6-one IUPAC Name: 5-benzyl-7-(2-methylpropyl)-4-(4-pyridin-2-ylpiperazin-1-yl)-7,8-dihydropteridin-6-one Traditional Name: 5-benzyl-7-isobutyl-4-[4-(2-pyridyl)piperazino]-7,8-dihydropteridin-6-one Formula: C26H31N7O MolecularWeight: 457.57064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(=O)N(C2=C(N1)N=CN=C2N3CCN(CC3)C4=CC=CC=N4)CC5=CC=CC=C5

Isomeric SMILES

CC(C)CC1C(=O)N(C2=C(N1)N=CN=C2N3CCN(CC3)C4=CC=CC=N4)CC5=CC=CC=C5

InChI

InChI=1S/C26H31N7O/c1-19(2)16-21-26(34)33(17-20-8-4-3-5-9-20)23-24(30-21)28-18-29-25(23)32-14-12-31(13-15-32)22-10-6-7-11-27-22/h3-11,18-19,21H,12-17H2,1-2H3,(H,28,29,30)