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

Systemtic Name: 2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]ethanamide Openeye Name: 2-(3,7-dimethyl-2,6-dioxo-purin-1-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide CAS Name: 2-(3,7-dimethyl-2,6-dioxo-1-purinyl)-N-methyl-N-[[2-(1-pyrrolidinyl)phenyl]methyl]acetamide IUPAC Name: 2-(3,7-dimethyl-2,6-dioxopurin-1-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide Traditional Name: 2-(2,6-diketo-3,7-dimethyl-purin-1-yl)-N-methyl-N-(2-pyrrolidinobenzyl)acetamide Formula: C21H26N6O3 MolecularWeight: 410.46954

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(=O)N(C)CC3=CC=CC=C3N4CCCC4

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(=O)N(C)CC3=CC=CC=C3N4CCCC4

InChI

InChI=1S/C21H26N6O3/c1-23(12-15-8-4-5-9-16(15)26-10-6-7-11-26)17(28)13-27-20(29)18-19(22-14-24(18)2)25(3)21(27)30/h4-5,8-9,14H,6-7,10-13H2,1-3H3