N-cyclopropyl-3-[6-(2-methoxyphenyl)purin-9-yl]-4-methyl-benzamide

Systemtic Name: N-cyclopropyl-3-[6-(2-methoxyphenyl)purin-9-yl]-4-methyl-benzamide Openeye Name: N-cyclopropyl-3-[6-(2-methoxyphenyl)purin-9-yl]-4-methyl-benzamide CAS Name: N-cyclopropyl-3-[6-(2-methoxyphenyl)-9-purinyl]-4-methylbenzamide IUPAC Name: N-cyclopropyl-3-[6-(2-methoxyphenyl)purin-9-yl]-4-methylbenzamide Traditional Name: N-cyclopropyl-3-[6-(2-methoxyphenyl)purin-9-yl]-4-methyl-benzamide Formula: C23H21N5O2 MolecularWeight: 399.44514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=NC4=C(N=CN=C43)C5=CC=CC=C5OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=NC4=C(N=CN=C43)C5=CC=CC=C5OC

InChI

InChI=1S/C23H21N5O2/c1-14-7-8-15(23(29)27-16-9-10-16)11-18(14)28-13-26-21-20(24-12-25-22(21)28)17-5-3-4-6-19(17)30-2/h3-8,11-13,16H,9-10H2,1-2H3,(H,27,29)