2-[2,6-bis(oxidanylidene)-3,7-bis(phenylmethyl)purin-1-yl]ethanehydrazide

Systemtic Name: 2-[2,6-bis(oxidanylidene)-3,7-bis(phenylmethyl)purin-1-yl]ethanehydrazide Openeye Name: 2-(3,7-dibenzyl-2,6-dioxo-purin-1-yl)acetohydrazide CAS Name: 2-[2,6-dioxo-3,7-bis(phenylmethyl)-1-purinyl]acetohydrazide IUPAC Name: 2-(3,7-dibenzyl-2,6-dioxopurin-1-yl)acetohydrazide Traditional Name: 2-(3,7-dibenzyl-2,6-diketo-purin-1-yl)acetohydrazide Formula: C21H20N6O3 MolecularWeight: 404.4219

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N(C(=O)N3CC4=CC=CC=C4)CC(=O)NN

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N(C(=O)N3CC4=CC=CC=C4)CC(=O)NN

InChI

InChI=1S/C21H20N6O3/c22-24-17(28)13-27-20(29)18-19(23-14-25(18)11-15-7-3-1-4-8-15)26(21(27)30)12-16-9-5-2-6-10-16/h1-10,14H,11-13,22H2,(H,24,28)