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

Systemtic Name: 5-methyl-3-phenyl-2-[phenyl-(7H-purin-6-ylamino)methyl]quinazolin-4-one Openeye Name: 5-methyl-3-phenyl-2-[phenyl-(7H-purin-6-ylamino)methyl]quinazolin-4-one CAS Name: 5-methyl-3-phenyl-2-[phenyl-(7H-purin-6-ylamino)methyl]-4-quinazolinone IUPAC Name: 5-methyl-3-phenyl-2-[phenyl-(7H-purin-6-ylamino)methyl]quinazolin-4-one Traditional Name: 5-methyl-3-phenyl-2-[phenyl-(7H-purin-6-ylamino)methyl]quinazolin-4-one Formula: C27H21N7O MolecularWeight: 459.50194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H21N7O/c1-17-9-8-14-20-21(17)27(35)34(19-12-6-3-7-13-19)26(32-20)22(18-10-4-2-5-11-18)33-25-23-24(29-15-28-23)30-16-31-25/h2-16,22H,1H3,(H2,28,29,30,31,33)