N-[4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-3-oxidanyl-butyl]-N-ethyl-pyridine-3-carboxamide

Systemtic Name: N-[4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-3-oxidanyl-butyl]-N-ethyl-pyridine-3-carboxamide Openeye Name: N-[4-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-3-hydroxy-butyl]-N-ethyl-pyridine-3-carboxamide CAS Name: N-[4-(1,3-dimethyl-2,6-dioxo-7-purinyl)-3-hydroxybutyl]-N-ethyl-3-pyridinecarboxamide IUPAC Name: N-[4-(1,3-dimethyl-2,6-dioxopurin-7-yl)-3-hydroxybutyl]-N-ethylpyridine-3-carboxamide Traditional Name: N-[4-(2,6-diketo-1,3-dimethyl-purin-7-yl)-3-hydroxy-butyl]-N-ethyl-nicotinamide Formula: C19H24N6O4 MolecularWeight: 400.43166

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC(CN1C=NC2=C1C(=O)N(C(=O)N2C)C)O)C(=O)C3=CN=CC=C3

Isomeric SMILES

CCN(CCC(CN1C=NC2=C1C(=O)N(C(=O)N2C)C)O)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C19H24N6O4/c1-4-24(17(27)13-6-5-8-20-10-13)9-7-14(26)11-25-12-21-16-15(25)18(28)23(3)19(29)22(16)2/h5-6,8,10,12,14,26H,4,7,9,11H2,1-3H3