6-azanyl-1,3-dimethyl-5-[2-(7H-purin-6-ylsulfanyl)ethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1,3-dimethyl-5-[2-(7H-purin-6-ylsulfanyl)ethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1,3-dimethyl-5-[2-(7H-purin-6-ylsulfanyl)acetyl]pyrimidine-2,4-dione CAS Name: 6-amino-1,3-dimethyl-5-[1-oxo-2-(7H-purin-6-ylthio)ethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-1,3-dimethyl-5-[2-(7H-purin-6-ylsulfanyl)acetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1,3-dimethyl-5-[2-(7H-purin-6-ylthio)acetyl]pyrimidine-2,4-quinone Formula: C13H13N7O3S MolecularWeight: 347.35242

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NC=NC3=C2NC=N3)N

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NC=NC3=C2NC=N3)N

InChI

InChI=1S/C13H13N7O3S/c1-19-9(14)7(12(22)20(2)13(19)23)6(21)3-24-11-8-10(16-4-15-8)17-5-18-11/h4-5H,3,14H2,1-2H3,(H,15,16,17,18)