5-methyl-3-phenyl-2-[1-(7H-purin-6-yl)pyrrolidin-2-yl]quinazolin-4-one

Systemtic Name: 5-methyl-3-phenyl-2-[1-(7H-purin-6-yl)pyrrolidin-2-yl]quinazolin-4-one Openeye Name: 5-methyl-3-phenyl-2-[1-(7H-purin-6-yl)pyrrolidin-2-yl]quinazolin-4-one CAS Name: 5-methyl-3-phenyl-2-[1-(7H-purin-6-yl)-2-pyrrolidinyl]-4-quinazolinone IUPAC Name: 5-methyl-3-phenyl-2-[1-(7H-purin-6-yl)pyrrolidin-2-yl]quinazolin-4-one Traditional Name: 5-methyl-3-phenyl-2-[1-(7H-purin-6-yl)pyrrolidin-2-yl]quinazolin-4-one Formula: C24H21N7O MolecularWeight: 423.46984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC=CC=C3)C4CCCN4C5=NC=NC6=C5NC=N6

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC=CC=C3)C4CCCN4C5=NC=NC6=C5NC=N6

InChI

InChI=1S/C24H21N7O/c1-15-7-5-10-17-19(15)24(32)31(16-8-3-2-4-9-16)22(29-17)18-11-6-12-30(18)23-20-21(26-13-25-20)27-14-28-23/h2-5,7-10,13-14,18H,6,11-12H2,1H3,(H,25,26,27,28)