2-(2,2-dimethylmorpholin-4-yl)-N-(4-methylsulfonylphenyl)-9-(1,3-thiazol-4-yl)purin-6-amine

Systemtic Name: 2-(2,2-dimethylmorpholin-4-yl)-N-(4-methylsulfonylphenyl)-9-(1,3-thiazol-4-yl)purin-6-amine Openeye Name: 2-(2,2-dimethylmorpholin-4-yl)-N-(4-methylsulfonylphenyl)-9-thiazol-4-yl-purin-6-amine CAS Name: 2-(2,2-dimethyl-4-morpholinyl)-N-(4-methylsulfonylphenyl)-9-(4-thiazolyl)-6-purinamine IUPAC Name: 2-(2,2-dimethylmorpholin-4-yl)-N-(4-methylsulfonylphenyl)-9-(1,3-thiazol-4-yl)purin-6-amine Traditional Name: [2-(2,2-dimethylmorpholino)-9-thiazol-4-yl-purin-6-yl]-(4-mesylphenyl)amine Formula: C21H23N7O3S2 MolecularWeight: 485.58242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CCO1)C2=NC3=C(C(=N2)NC4=CC=C(C=C4)S(=O)(=O)C)N=CN3C5=CSC=N5)C

Isomeric SMILES

CC1(CN(CCO1)C2=NC3=C(C(=N2)NC4=CC=C(C=C4)S(=O)(=O)C)N=CN3C5=CSC=N5)C

InChI

InChI=1S/C21H23N7O3S2/c1-21(2)11-27(8-9-31-21)20-25-18(24-14-4-6-15(7-5-14)33(3,29)30)17-19(26-20)28(12-22-17)16-10-32-13-23-16/h4-7,10,12-13H,8-9,11H2,1-3H3,(H,24,25,26)