N-[11-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]undecyl]-N-pyrrolidin-2-yl-methanamide

Systemtic Name: N-[11-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]undecyl]-N-pyrrolidin-2-yl-methanamide Openeye Name: N-[11-(3,7-dimethyl-2,6-dioxo-purin-1-yl)undecyl]-N-pyrrolidin-2-yl-formamide CAS Name: N-[11-(3,7-dimethyl-2,6-dioxo-1-purinyl)undecyl]-N-(2-pyrrolidinyl)formamide IUPAC Name: N-[11-(3,7-dimethyl-2,6-dioxopurin-1-yl)undecyl]-N-pyrrolidin-2-ylformamide Traditional Name: N-[11-(2,6-diketo-3,7-dimethyl-purin-1-yl)undecyl]-N-pyrrolidin-2-yl-formamide Formula: C23H38N6O3 MolecularWeight: 446.58622

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCCCCCCN(C=O)C3CCCN3

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCCCCCCN(C=O)C3CCCN3

InChI

InChI=1S/C23H38N6O3/c1-26-17-25-21-20(26)22(31)29(23(32)27(21)2)16-11-9-7-5-3-4-6-8-10-15-28(18-30)19-13-12-14-24-19/h17-19,24H,3-16H2,1-2H3