2-[(6-aminopurin-9-yl)methyl]-5-methyl-3-(2-phenylmethoxyphenyl)quinazolin-4-one

Systemtic Name: 2-[(6-aminopurin-9-yl)methyl]-5-methyl-3-(2-phenylmethoxyphenyl)quinazolin-4-one Openeye Name: 2-[(6-aminopurin-9-yl)methyl]-3-(2-benzyloxyphenyl)-5-methyl-quinazolin-4-one CAS Name: 2-[(6-aminopurin-9-yl)methyl]-5-methyl-3-(2-phenylmethoxyphenyl)-4-quinazolinone IUPAC Name: 2-[(6-aminopurin-9-yl)methyl]-5-methyl-3-(2-phenylmethoxyphenyl)quinazolin-4-one Traditional Name: 2-(adenin-9-ylmethyl)-3-(2-benzoxyphenyl)-5-methyl-quinazolin-4-one Formula: C28H23N7O2 MolecularWeight: 489.52792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC=CC=C3OCC4=CC=CC=C4)CN5C=NC6=C5N=CN=C6N

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC=CC=C3OCC4=CC=CC=C4)CN5C=NC6=C5N=CN=C6N

InChI

InChI=1S/C28H23N7O2/c1-18-8-7-11-20-24(18)28(36)35(21-12-5-6-13-22(21)37-15-19-9-3-2-4-10-19)23(33-20)14-34-17-32-25-26(29)30-16-31-27(25)34/h2-13,16-17H,14-15H2,1H3,(H2,29,30,31)