1,3-diethyl-8-oxidanyl-9-(phenylmethyl)purino[7,8-a]pyrimidine-2,4,6-trione

Systemtic Name: 1,3-diethyl-8-oxidanyl-9-(phenylmethyl)purino[7,8-a]pyrimidine-2,4,6-trione Openeye Name: 9-benzyl-1,3-diethyl-8-hydroxy-purino[7,8-a]pyrimidine-2,4,6-trione CAS Name: 1,3-diethyl-8-hydroxy-9-(phenylmethyl)purino[7,8-a]pyrimidine-2,4,6-trione IUPAC Name: 9-benzyl-1,3-diethyl-8-hydroxypurino[7,8-a]pyrimidine-2,4,6-trione Traditional Name: 9-benzyl-1,3-diethyl-8-hydroxy-purino[7,8-a]pyrimidine-2,4,6-trione Formula: C19H19N5O4 MolecularWeight: 381.38526

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)N(C1=O)CC)N3C(=O)C=C(N(C3=N2)CC4=CC=CC=C4)O

Isomeric SMILES

CCN1C2=C(C(=O)N(C1=O)CC)N3C(=O)C=C(N(C3=N2)CC4=CC=CC=C4)O

InChI

InChI=1S/C19H19N5O4/c1-3-21-16-15(17(27)22(4-2)19(21)28)24-14(26)10-13(25)23(18(24)20-16)11-12-8-6-5-7-9-12/h5-10,25H,3-4,11H2,1-2H3