2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(4-pyrrolidin-1-ylphenyl)ethanamide

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(4-pyrrolidin-1-ylphenyl)ethanamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(4-pyrrolidin-1-ylphenyl)acetamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-[4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(4-pyrrolidinophenyl)acetamide Formula: C19H22N6O3 MolecularWeight: 382.41638

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NC3=CC=C(C=C3)N4CCCC4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NC3=CC=C(C=C3)N4CCCC4

InChI

InChI=1S/C19H22N6O3/c1-22-17-16(18(27)23(2)19(22)28)25(12-20-17)11-15(26)21-13-5-7-14(8-6-13)24-9-3-4-10-24/h5-8,12H,3-4,9-11H2,1-2H3,(H,21,26)