2-[2,3-dihydro-1H-inden-2-yl(oxidanyl)amino]-1-methyl-7-(phenylmethyl)purin-6-one

Systemtic Name: 2-[2,3-dihydro-1H-inden-2-yl(oxidanyl)amino]-1-methyl-7-(phenylmethyl)purin-6-one Openeye Name: 7-benzyl-2-[hydroxy(indan-2-yl)amino]-1-methyl-purin-6-one CAS Name: 2-[2,3-dihydro-1H-inden-2-yl(hydroxy)amino]-1-methyl-7-(phenylmethyl)-6-purinone IUPAC Name: 7-benzyl-2-[2,3-dihydro-1H-inden-2-yl(hydroxy)amino]-1-methylpurin-6-one Traditional Name: 7-benzyl-2-[hydroxy(indan-2-yl)amino]-1-methyl-purin-6-one Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=CN2CC3=CC=CC=C3)N=C1N(C4CC5=CC=CC=C5C4)O

Isomeric SMILES

CN1C(=O)C2=C(N=CN2CC3=CC=CC=C3)N=C1N(C4CC5=CC=CC=C5C4)O

InChI

InChI=1S/C22H21N5O2/c1-25-21(28)19-20(23-14-26(19)13-15-7-3-2-4-8-15)24-22(25)27(29)18-11-16-9-5-6-10-17(16)12-18/h2-10,14,18,29H,11-13H2,1H3