9-cyclopentyl-2-[(2-methoxy-4-morpholin-4-yl-phenyl)amino]-7-methyl-purin-8-one

Systemtic Name: 9-cyclopentyl-2-[(2-methoxy-4-morpholin-4-yl-phenyl)amino]-7-methyl-purin-8-one Openeye Name: 9-cyclopentyl-2-(2-methoxy-4-morpholino-anilino)-7-methyl-purin-8-one CAS Name: 9-cyclopentyl-2-[2-methoxy-4-(4-morpholinyl)anilino]-7-methyl-8-purinone IUPAC Name: 9-cyclopentyl-2-(2-methoxy-4-morpholin-4-ylanilino)-7-methylpurin-8-one Traditional Name: 9-cyclopentyl-2-(2-methoxy-4-morpholino-anilino)-7-methyl-purin-8-one Formula: C22H28N6O3 MolecularWeight: 424.49612

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CN=C(N=C2N(C1=O)C3CCCC3)NC4=C(C=C(C=C4)N5CCOCC5)OC

Isomeric SMILES

CN1C2=CN=C(N=C2N(C1=O)C3CCCC3)NC4=C(C=C(C=C4)N5CCOCC5)OC

InChI

InChI=1S/C22H28N6O3/c1-26-18-14-23-21(25-20(18)28(22(26)29)15-5-3-4-6-15)24-17-8-7-16(13-19(17)30-2)27-9-11-31-12-10-27/h7-8,13-15H,3-6,9-12H2,1-2H3,(H,23,24,25)