4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)butanamide

Systemtic Name: 4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)butanamide Openeye Name: 4-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)butanamide CAS Name: 4-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)butanamide IUPAC Name: 4-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)butanamide Traditional Name: 4-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(2-keto-1,3-dihydrobenzimidazol-5-yl)butyramide Formula: C18H19N7O4 MolecularWeight: 397.38796

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCC(=O)NC3=CC4=C(C=C3)NC(=O)N4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCC(=O)NC3=CC4=C(C=C3)NC(=O)N4

InChI

InChI=1S/C18H19N7O4/c1-23-15-14(16(27)24(2)18(23)29)25(9-19-15)7-3-4-13(26)20-10-5-6-11-12(8-10)22-17(28)21-11/h5-6,8-9H,3-4,7H2,1-2H3,(H,20,26)(H2,21,22,28)