3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-pyridin-4-yl-propanamide

Systemtic Name: 3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-pyridin-4-yl-propanamide Openeye Name: 3-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(4-pyridyl)propanamide CAS Name: 3-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-pyridin-4-ylpropanamide IUPAC Name: 3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-pyridin-4-ylpropanamide Traditional Name: 3-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(4-pyridyl)propionamide Formula: C15H16N6O3 MolecularWeight: 328.32594

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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=NC=C3

Isomeric SMILES

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

InChI

InChI=1S/C15H16N6O3/c1-19-13-12(14(23)20(2)15(19)24)21(9-17-13)8-5-11(22)18-10-3-6-16-7-4-10/h3-4,6-7,9H,5,8H2,1-2H3,(H,16,18,22)