N'-[4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]butanoyl]adamantane-1-carbohydrazide

Systemtic Name: N'-[4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]butanoyl]adamantane-1-carbohydrazide Openeye Name: N'-[4-(1,3-dimethyl-2,6-dioxo-purin-7-yl)butanoyl]adamantane-1-carbohydrazide CAS Name: N'-[4-(1,3-dimethyl-2,6-dioxo-7-purinyl)-1-oxobutyl]-1-adamantanecarbohydrazide IUPAC Name: N'-[4-(1,3-dimethyl-2,6-dioxopurin-7-yl)butanoyl]adamantane-1-carbohydrazide Traditional Name: N'-[4-(2,6-diketo-1,3-dimethyl-purin-7-yl)butanoyl]adamantane-1-carbohydrazide Formula: C22H30N6O4 MolecularWeight: 442.5114

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCC(=O)NNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCC(=O)NNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H30N6O4/c1-26-18-17(19(30)27(2)21(26)32)28(12-23-18)5-3-4-16(29)24-25-20(31)22-9-13-6-14(10-22)8-15(7-13)11-22/h12-15H,3-11H2,1-2H3,(H,24,29)(H,25,31)