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

Systemtic Name: N-(1-adamantylmethyl)-2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanamide Openeye Name: N-(1-adamantylmethyl)-2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetamide CAS Name: N-(1-adamantylmethyl)-2-(1,3-dimethyl-2,6-dioxo-7-purinyl)acetamide IUPAC Name: N-(1-adamantylmethyl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide Traditional Name: N-(1-adamantylmethyl)-2-(2,6-diketo-1,3-dimethyl-purin-7-yl)acetamide Formula: C20H27N5O3 MolecularWeight: 385.46008

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C20H27N5O3/c1-23-17-16(18(27)24(2)19(23)28)25(11-22-17)9-15(26)21-10-20-6-12-3-13(7-20)5-14(4-12)8-20/h11-14H,3-10H2,1-2H3,(H,21,26)