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3-methyl-1,7-bis(phenylmethyl)-8-[(phenylmethyl)amino]purine-2,6-dione
3-methyl-1,7-bis(phenylmethyl)-8-[(phenylmethyl)amino]purine-2,6-dione
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Descriptors Computed from Structure
Canonical SMILES:
CN1C2=C(C(=O)N(C1=O)CC3=CC=CC=C3)N(C(=N2)NCC4=CC=CC=C4)CC5=CC=CC=C5
Isomeric SMILES
CN1C2=C(C(=O)N(C1=O)CC3=CC=CC=C3)N(C(=N2)NCC4=CC=CC=C4)CC5=CC=CC=C5
InChI
InChI=1S/C27H25N5O2/c1-30-24-23(25(33)32(27(30)34)19-22-15-9-4-10-16-22)31(18-21-13-7-3-8-14-21)26(29-24)28-17-20-11-5-2-6-12-20/h2-16H,17-19H2,1H3,(H,28,29)
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