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

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-[(E)-(4-phenylmethoxyphenyl)methylideneamino]ethanamide Openeye Name: N-[(E)-(4-benzyloxyphenyl)methyleneamino]-2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-[(E)-(4-phenylmethoxyphenyl)methylideneamino]acetamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(E)-(4-phenylmethoxyphenyl)methylideneamino]acetamide Traditional Name: N-[(E)-(4-benzoxybenzylidene)amino]-2-(2,6-diketo-1,3-dimethyl-purin-7-yl)acetamide Formula: C23H22N6O4 MolecularWeight: 446.45858

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NN=CC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)N/N=C/C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H22N6O4/c1-27-21-20(22(31)28(2)23(27)32)29(15-24-21)13-19(30)26-25-12-16-8-10-18(11-9-16)33-14-17-6-4-3-5-7-17/h3-12,15H,13-14H2,1-2H3,(H,26,30)/b25-12+