2-[[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]sulfanyl]propanediamide

Systemtic Name: 2-[[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]sulfanyl]propanediamide Openeye Name: 2-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)sulfanyl]propanediamide CAS Name: 2-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)thio]propanediamide IUPAC Name: 2-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)sulfanyl]propanediamide Traditional Name: 2-[(2,6-diketo-1,3-dimethyl-7H-purin-8-yl)thio]malonamide Formula: C10H12N6O4S MolecularWeight: 312.30508

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)SC(C(=O)N)C(=O)N

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)SC(C(=O)N)C(=O)N

InChI

InChI=1S/C10H12N6O4S/c1-15-7-3(8(19)16(2)10(15)20)13-9(14-7)21-4(5(11)17)6(12)18/h4H,1-2H3,(H2,11,17)(H2,12,18)(H,13,14)