3-(2-fluoranyl-6-methyl-phenyl)-5-methyl-2-[1-(7H-purin-6-ylamino)propyl]quinazolin-4-one

Systemtic Name: 3-(2-fluoranyl-6-methyl-phenyl)-5-methyl-2-[1-(7H-purin-6-ylamino)propyl]quinazolin-4-one Openeye Name: 3-(2-fluoro-6-methyl-phenyl)-5-methyl-2-[1-(7H-purin-6-ylamino)propyl]quinazolin-4-one CAS Name: 3-(2-fluoro-6-methylphenyl)-5-methyl-2-[1-(7H-purin-6-ylamino)propyl]-4-quinazolinone IUPAC Name: 3-(2-fluoro-6-methylphenyl)-5-methyl-2-[1-(7H-purin-6-ylamino)propyl]quinazolin-4-one Traditional Name: 3-(2-fluoro-6-methyl-phenyl)-5-methyl-2-[1-(7H-purin-6-ylamino)propyl]quinazolin-4-one Formula: C24H22FN7O MolecularWeight: 443.476183

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC(=C2C(=O)N1C3=C(C=CC=C3F)C)C)NC4=NC=NC5=C4NC=N5

Isomeric SMILES

CCC(C1=NC2=CC=CC(=C2C(=O)N1C3=C(C=CC=C3F)C)C)NC4=NC=NC5=C4NC=N5

InChI

InChI=1S/C24H22FN7O/c1-4-16(30-22-19-21(27-11-26-19)28-12-29-22)23-31-17-10-6-7-13(2)18(17)24(33)32(23)20-14(3)8-5-9-15(20)25/h5-12,16H,4H2,1-3H3,(H2,26,27,28,29,30)