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

Systemtic Name: 3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(2-pyrrolidin-1-ylphenyl)propanamide Openeye Name: 3-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(2-pyrrolidin-1-ylphenyl)propanamide CAS Name: 3-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-[2-(1-pyrrolidinyl)phenyl]propanamide IUPAC Name: 3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(2-pyrrolidin-1-ylphenyl)propanamide Traditional Name: 3-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(2-pyrrolidinophenyl)propionamide Formula: C20H24N6O3 MolecularWeight: 396.44296

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCC(=O)NC3=CC=CC=C3N4CCCC4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCC(=O)NC3=CC=CC=C3N4CCCC4

InChI

InChI=1S/C20H24N6O3/c1-23-18-17(19(28)24(2)20(23)29)26(13-21-18)12-9-16(27)22-14-7-3-4-8-15(14)25-10-5-6-11-25/h3-4,7-8,13H,5-6,9-12H2,1-2H3,(H,22,27)