N-(1H-benzimidazol-2-ylmethyl)-2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]ethanamide

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]ethanamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-2-(3,7-dimethyl-2,6-dioxo-purin-1-yl)acetamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-2-(3,7-dimethyl-2,6-dioxo-1-purinyl)acetamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-2-(3,7-dimethyl-2,6-dioxopurin-1-yl)acetamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-2-(2,6-diketo-3,7-dimethyl-purin-1-yl)acetamide Formula: C17H17N7O3 MolecularWeight: 367.36198

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(=O)NCC3=NC4=CC=CC=C4N3

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(=O)NCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C17H17N7O3/c1-22-9-19-15-14(22)16(26)24(17(27)23(15)2)8-13(25)18-7-12-20-10-5-3-4-6-11(10)21-12/h3-6,9H,7-8H2,1-2H3,(H,18,25)(H,20,21)