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

Systemtic Name: N-cyclopropyl-4-methyl-3-[6-(2-morpholin-4-ylphenyl)purin-9-yl]benzamide Openeye Name: N-cyclopropyl-4-methyl-3-[6-(2-morpholinophenyl)purin-9-yl]benzamide CAS Name: N-cyclopropyl-4-methyl-3-[6-[2-(4-morpholinyl)phenyl]-9-purinyl]benzamide IUPAC Name: N-cyclopropyl-4-methyl-3-[6-(2-morpholin-4-ylphenyl)purin-9-yl]benzamide Traditional Name: N-cyclopropyl-4-methyl-3-[6-(2-morpholinophenyl)purin-9-yl]benzamide Formula: C26H26N6O2 MolecularWeight: 454.52364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=NC4=C(N=CN=C43)C5=CC=CC=C5N6CCOCC6

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=NC4=C(N=CN=C43)C5=CC=CC=C5N6CCOCC6

InChI

InChI=1S/C26H26N6O2/c1-17-6-7-18(26(33)30-19-8-9-19)14-22(17)32-16-29-24-23(27-15-28-25(24)32)20-4-2-3-5-21(20)31-10-12-34-13-11-31/h2-7,14-16,19H,8-13H2,1H3,(H,30,33)