2-butoxy-9-[(4-methylsulfonylphenyl)methyl]-N-(2-morpholin-4-ylethyl)purin-6-amine

Systemtic Name: 2-butoxy-9-[(4-methylsulfonylphenyl)methyl]-N-(2-morpholin-4-ylethyl)purin-6-amine Openeye Name: 2-butoxy-9-[(4-methylsulfonylphenyl)methyl]-N-(2-morpholinoethyl)purin-6-amine CAS Name: 2-butoxy-9-[(4-methylsulfonylphenyl)methyl]-N-[2-(4-morpholinyl)ethyl]-6-purinamine IUPAC Name: 2-butoxy-9-[(4-methylsulfonylphenyl)methyl]-N-(2-morpholin-4-ylethyl)purin-6-amine Traditional Name: [2-butoxy-9-(4-mesylbenzyl)purin-6-yl]-(2-morpholinoethyl)amine Formula: C23H32N6O4S MolecularWeight: 488.60298

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC2=C(C(=N1)NCCN3CCOCC3)N=CN2CC4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CCCCOC1=NC2=C(C(=N1)NCCN3CCOCC3)N=CN2CC4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C23H32N6O4S/c1-3-4-13-33-23-26-21(24-9-10-28-11-14-32-15-12-28)20-22(27-23)29(17-25-20)16-18-5-7-19(8-6-18)34(2,30)31/h5-8,17H,3-4,9-16H2,1-2H3,(H,24,26,27)