2-[2-[1-[(6-aminopurin-9-yl)methyl]-5-methyl-4-oxidanylidene-2H-quinazolin-3-yl]phenoxy]ethanamide

Systemtic Name: 2-[2-[1-[(6-aminopurin-9-yl)methyl]-5-methyl-4-oxidanylidene-2H-quinazolin-3-yl]phenoxy]ethanamide Openeye Name: 2-[2-[1-[(6-aminopurin-9-yl)methyl]-5-methyl-4-oxo-2H-quinazolin-3-yl]phenoxy]acetamide CAS Name: 2-[2-[1-[(6-aminopurin-9-yl)methyl]-5-methyl-4-oxo-2H-quinazolin-3-yl]phenoxy]acetamide IUPAC Name: 2-[2-[1-[(6-aminopurin-9-yl)methyl]-5-methyl-4-oxo-2H-quinazolin-3-yl]phenoxy]acetamide Traditional Name: 2-[2-[1-(adenin-9-ylmethyl)-4-keto-5-methyl-2H-quinazolin-3-yl]phenoxy]acetamide Formula: C23H22N8O3 MolecularWeight: 458.47258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N(CN(C2=O)C3=CC=CC=C3OCC(=O)N)CN4C=NC5=C4N=CN=C5N

Isomeric SMILES

CC1=C2C(=CC=C1)N(CN(C2=O)C3=CC=CC=C3OCC(=O)N)CN4C=NC5=C4N=CN=C5N

InChI

InChI=1S/C23H22N8O3/c1-14-5-4-7-16-19(14)23(33)31(15-6-2-3-8-17(15)34-9-18(24)32)13-30(16)12-29-11-28-20-21(25)26-10-27-22(20)29/h2-8,10-11H,9,12-13H2,1H3,(H2,24,32)(H2,25,26,27)