5-methyl-3-(2-methylphenyl)-2-[1-(7H-purin-6-ylamino)ethyl]quinazolin-4-one

Systemtic Name: 5-methyl-3-(2-methylphenyl)-2-[1-(7H-purin-6-ylamino)ethyl]quinazolin-4-one Openeye Name: 5-methyl-3-(o-tolyl)-2-[1-(7H-purin-6-ylamino)ethyl]quinazolin-4-one CAS Name: 5-methyl-3-(2-methylphenyl)-2-[1-(7H-purin-6-ylamino)ethyl]-4-quinazolinone IUPAC Name: 5-methyl-3-(2-methylphenyl)-2-[1-(7H-purin-6-ylamino)ethyl]quinazolin-4-one Traditional Name: 5-methyl-3-(o-tolyl)-2-[1-(7H-purin-6-ylamino)ethyl]quinazolin-4-one Formula: C23H21N7O MolecularWeight: 411.45914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC=CC=C3C)C(C)NC4=NC=NC5=C4NC=N5

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC=CC=C3C)C(C)NC4=NC=NC5=C4NC=N5

InChI

InChI=1S/C23H21N7O/c1-13-7-4-5-10-17(13)30-22(29-16-9-6-8-14(2)18(16)23(30)31)15(3)28-21-19-20(25-11-24-19)26-12-27-21/h4-12,15H,1-3H3,(H2,24,25,26,27,28)