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

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-[(E)-1-pyridin-4-ylethylideneamino]ethanamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-[(E)-1-(4-pyridyl)ethylideneamino]acetamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-[(E)-1-pyridin-4-ylethylideneamino]acetamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(E)-1-pyridin-4-ylethylideneamino]acetamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-[(E)-1-(4-pyridyl)ethylideneamino]acetamide Formula: C16H17N7O3 MolecularWeight: 355.35128

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CN1C=NC2=C1C(=O)N(C(=O)N2C)C)C3=CC=NC=C3

Isomeric SMILES

C/C(=N\NC(=O)CN1C=NC2=C1C(=O)N(C(=O)N2C)C)/C3=CC=NC=C3

InChI

InChI=1S/C16H17N7O3/c1-10(11-4-6-17-7-5-11)19-20-12(24)8-23-9-18-14-13(23)15(25)22(3)16(26)21(14)2/h4-7,9H,8H2,1-3H3,(H,20,24)/b19-10+