5-methyl-1-[3-(6-oxidanylidene-3H-purin-9-yl)propyl]pyrimidine-2,4-dione

Systemtic Name: 5-methyl-1-[3-(6-oxidanylidene-3H-purin-9-yl)propyl]pyrimidine-2,4-dione Openeye Name: 5-methyl-1-[3-(6-oxo-3H-purin-9-yl)propyl]pyrimidine-2,4-dione CAS Name: 5-methyl-1-[3-(6-oxo-3H-purin-9-yl)propyl]pyrimidine-2,4-dione IUPAC Name: 5-methyl-1-[3-(6-oxo-3H-purin-9-yl)propyl]pyrimidine-2,4-dione Traditional Name: 1-[3-(6-keto-3H-purin-9-yl)propyl]-5-methyl-pyrimidine-2,4-quinone Formula: C13H14N6O3 MolecularWeight: 302.28866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)CCCN2C=NC3=C2NC=NC3=O

Isomeric SMILES

CC1=CN(C(=O)NC1=O)CCCN2C=NC3=C2NC=NC3=O

InChI

InChI=1S/C13H14N6O3/c1-8-5-18(13(22)17-11(8)20)3-2-4-19-7-16-9-10(19)14-6-15-12(9)21/h5-7H,2-4H2,1H3,(H,14,15,21)(H,17,20,22)