9-butyl-8-oxidanyl-7-phenyl-1,3-dipropyl-purino[7,8-a]pyrimidine-2,4,6-trione

Systemtic Name: 9-butyl-8-oxidanyl-7-phenyl-1,3-dipropyl-purino[7,8-a]pyrimidine-2,4,6-trione Openeye Name: 9-butyl-8-hydroxy-7-phenyl-1,3-dipropyl-purino[7,8-a]pyrimidine-2,4,6-trione CAS Name: 9-butyl-8-hydroxy-7-phenyl-1,3-dipropylpurino[7,8-a]pyrimidine-2,4,6-trione IUPAC Name: 9-butyl-8-hydroxy-7-phenyl-1,3-dipropylpurino[7,8-a]pyrimidine-2,4,6-trione Traditional Name: 9-butyl-8-hydroxy-7-phenyl-1,3-dipropyl-purino[7,8-a]pyrimidine-2,4,6-trione Formula: C24H29N5O4 MolecularWeight: 451.51816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)N2C1=NC3=C2C(=O)N(C(=O)N3CCC)CCC)C4=CC=CC=C4)O

Isomeric SMILES

CCCCN1C(=C(C(=O)N2C1=NC3=C2C(=O)N(C(=O)N3CCC)CCC)C4=CC=CC=C4)O

InChI

InChI=1S/C24H29N5O4/c1-4-7-15-27-20(30)17(16-11-9-8-10-12-16)21(31)29-18-19(25-23(27)29)26(13-5-2)24(33)28(14-6-3)22(18)32/h8-12,30H,4-7,13-15H2,1-3H3