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

Systemtic Name: 5-methyl-3-phenyl-2-[2-phenylmethoxy-1-(7H-purin-6-ylamino)ethyl]quinazolin-4-one Openeye Name: 2-[2-benzyloxy-1-(7H-purin-6-ylamino)ethyl]-5-methyl-3-phenyl-quinazolin-4-one CAS Name: 5-methyl-3-phenyl-2-[2-phenylmethoxy-1-(7H-purin-6-ylamino)ethyl]-4-quinazolinone IUPAC Name: 5-methyl-3-phenyl-2-[2-phenylmethoxy-1-(7H-purin-6-ylamino)ethyl]quinazolin-4-one Traditional Name: 2-[2-benzoxy-1-(7H-purin-6-ylamino)ethyl]-5-methyl-3-phenyl-quinazolin-4-one Formula: C29H25N7O2 MolecularWeight: 503.5545

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC=CC=C3)C(COCC4=CC=CC=C4)NC5=NC=NC6=C5NC=N6

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC=CC=C3)C(COCC4=CC=CC=C4)NC5=NC=NC6=C5NC=N6

InChI

InChI=1S/C29H25N7O2/c1-19-9-8-14-22-24(19)29(37)36(21-12-6-3-7-13-21)28(35-22)23(16-38-15-20-10-4-2-5-11-20)34-27-25-26(31-17-30-25)32-18-33-27/h2-14,17-18,23H,15-16H2,1H3,(H2,30,31,32,33,34)