4-tert-butyl-N-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoyl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoyl]benzamide Openeye Name: 4-tert-butyl-N-[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]benzamide CAS Name: 4-tert-butyl-N-[2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-1-oxoethyl]benzamide IUPAC Name: 4-tert-butyl-N-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]benzamide Traditional Name: 4-tert-butyl-N-[2-(2,6-diketo-1,3-dimethyl-purin-7-yl)acetyl]benzamide Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C20H23N5O4/c1-20(2,3)13-8-6-12(7-9-13)17(27)22-14(26)10-25-11-21-16-15(25)18(28)24(5)19(29)23(16)4/h6-9,11H,10H2,1-5H3,(H,22,26,27)