N-(2-chloranylpyridin-3-yl)-2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanamide

Systemtic Name: N-(2-chloranylpyridin-3-yl)-2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanamide Openeye Name: N-(2-chloro-3-pyridyl)-2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetamide CAS Name: N-(2-chloro-3-pyridinyl)-2-(1,3-dimethyl-2,6-dioxo-7-purinyl)acetamide IUPAC Name: N-(2-chloropyridin-3-yl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide Traditional Name: N-(2-chloro-3-pyridyl)-2-(2,6-diketo-1,3-dimethyl-purin-7-yl)acetamide Formula: C14H13ClN6O3 MolecularWeight: 348.74442

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NC3=C(N=CC=C3)Cl

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NC3=C(N=CC=C3)Cl

InChI

InChI=1S/C14H13ClN6O3/c1-19-12-10(13(23)20(2)14(19)24)21(7-17-12)6-9(22)18-8-4-3-5-16-11(8)15/h3-5,7H,6H2,1-2H3,(H,18,22)