5-methyl-3-(2-methylphenyl)-2-[1-[(2-methyl-7H-purin-6-yl)amino]propyl]quinazolin-4-one

Systemtic Name: 5-methyl-3-(2-methylphenyl)-2-[1-[(2-methyl-7H-purin-6-yl)amino]propyl]quinazolin-4-one Openeye Name: 5-methyl-2-[1-[(2-methyl-7H-purin-6-yl)amino]propyl]-3-(o-tolyl)quinazolin-4-one CAS Name: 5-methyl-3-(2-methylphenyl)-2-[1-[(2-methyl-7H-purin-6-yl)amino]propyl]-4-quinazolinone IUPAC Name: 5-methyl-3-(2-methylphenyl)-2-[1-[(2-methyl-7H-purin-6-yl)amino]propyl]quinazolin-4-one Traditional Name: 5-methyl-2-[1-[(2-methyl-7H-purin-6-yl)amino]propyl]-3-(o-tolyl)quinazolin-4-one Formula: C25H25N7O MolecularWeight: 439.5123

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC(=C2C(=O)N1C3=CC=CC=C3C)C)NC4=NC(=NC5=C4NC=N5)C

Isomeric SMILES

CCC(C1=NC2=CC=CC(=C2C(=O)N1C3=CC=CC=C3C)C)NC4=NC(=NC5=C4NC=N5)C

InChI

InChI=1S/C25H25N7O/c1-5-17(30-23-21-22(27-13-26-21)28-16(4)29-23)24-31-18-11-8-10-15(3)20(18)25(33)32(24)19-12-7-6-9-14(19)2/h6-13,17H,5H2,1-4H3,(H2,26,27,28,29,30)