8-(6-chloranylpyridin-3-yl)-1,3-diethyl-5,7-dihydro-4H-purine-2,6-dione

Systemtic Name: 8-(6-chloranylpyridin-3-yl)-1,3-diethyl-5,7-dihydro-4H-purine-2,6-dione Openeye Name: 8-(6-chloro-3-pyridyl)-1,3-diethyl-5,7-dihydro-4H-purine-2,6-dione CAS Name: 8-(6-chloro-3-pyridinyl)-1,3-diethyl-5,7-dihydro-4H-purine-2,6-dione IUPAC Name: 8-(6-chloropyridin-3-yl)-1,3-diethyl-5,7-dihydro-4H-purine-2,6-dione Traditional Name: 8-(6-chloro-3-pyridyl)-1,3-diethyl-5,7-dihydro-4H-purine-2,6-quinone Formula: C14H16ClN5O2 MolecularWeight: 321.76214

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2C(C(=O)N(C1=O)CC)NC(=N2)C3=CN=C(C=C3)Cl

Isomeric SMILES

CCN1C2C(C(=O)N(C1=O)CC)NC(=N2)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C14H16ClN5O2/c1-3-19-12-10(13(21)20(4-2)14(19)22)17-11(18-12)8-5-6-9(15)16-7-8/h5-7,10,12H,3-4H2,1-2H3,(H,17,18)