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

Systemtic Name: 2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(1-pyridin-4-ylethyl)ethanamide Openeye Name: 2-(3,7-dimethyl-2,6-dioxo-purin-1-yl)-N-[1-(4-pyridyl)ethyl]acetamide CAS Name: 2-(3,7-dimethyl-2,6-dioxo-1-purinyl)-N-(1-pyridin-4-ylethyl)acetamide IUPAC Name: 2-(3,7-dimethyl-2,6-dioxopurin-1-yl)-N-(1-pyridin-4-ylethyl)acetamide Traditional Name: 2-(2,6-diketo-3,7-dimethyl-purin-1-yl)-N-[1-(4-pyridyl)ethyl]acetamide Formula: C16H18N6O3 MolecularWeight: 342.35252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=NC=C1)NC(=O)CN2C(=O)C3=C(N=CN3C)N(C2=O)C

Isomeric SMILES

CC(C1=CC=NC=C1)NC(=O)CN2C(=O)C3=C(N=CN3C)N(C2=O)C

InChI

InChI=1S/C16H18N6O3/c1-10(11-4-6-17-7-5-11)19-12(23)8-22-15(24)13-14(18-9-20(13)2)21(3)16(22)25/h4-7,9-10H,8H2,1-3H3,(H,19,23)