2-[(2-oxidanylidene-3,7-dihydropurin-6-yl)sulfanyl]-N-pyrimidin-2-yl-ethanamide

Systemtic Name: 2-[(2-oxidanylidene-3,7-dihydropurin-6-yl)sulfanyl]-N-pyrimidin-2-yl-ethanamide Openeye Name: 2-[(2-oxo-3,7-dihydropurin-6-yl)sulfanyl]-N-pyrimidin-2-yl-acetamide CAS Name: 2-[(2-oxo-3,7-dihydropurin-6-yl)thio]-N-(2-pyrimidinyl)acetamide IUPAC Name: 2-[(2-oxo-3,7-dihydropurin-6-yl)sulfanyl]-N-pyrimidin-2-ylacetamide Traditional Name: 2-[(2-keto-3,7-dihydropurin-6-yl)thio]-N-(2-pyrimidyl)acetamide Formula: C11H9N7O2S MolecularWeight: 303.29986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9N7O2S/c19-6(16-10-12-2-1-3-13-10)4-21-9-7-8(15-5-14-7)17-11(20)18-9/h1-3,5H,4H2,(H,12,13,16,19)(H2,14,15,17,18,20)