3-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]propyl 3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanoate

Systemtic Name: 3-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]propyl 3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanoate Openeye Name: 3-(3,7-dimethyl-2,6-dioxo-purin-1-yl)propyl 3-(3-methyl-4-oxo-quinazolin-2-yl)propanoate CAS Name: 3-(3-methyl-4-oxo-2-quinazolinyl)propanoic acid 3-(3,7-dimethyl-2,6-dioxo-1-purinyl)propyl ester IUPAC Name: 3-(3,7-dimethyl-2,6-dioxopurin-1-yl)propyl 3-(3-methyl-4-oxoquinazolin-2-yl)propanoate Traditional Name: 3-(4-keto-3-methyl-quinazolin-2-yl)propionic acid 3-(2,6-diketo-3,7-dimethyl-purin-1-yl)propyl ester Formula: C22H24N6O5 MolecularWeight: 452.46316

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCOC(=O)CCC3=NC4=CC=CC=C4C(=O)N3C

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCOC(=O)CCC3=NC4=CC=CC=C4C(=O)N3C

InChI

InChI=1S/C22H24N6O5/c1-25-13-23-19-18(25)21(31)28(22(32)27(19)3)11-6-12-33-17(29)10-9-16-24-15-8-5-4-7-14(15)20(30)26(16)2/h4-5,7-8,13H,6,9-12H2,1-3H3