N-[[6-[(4-methoxyphenyl)methylamino]-9-(oxan-2-yl)purin-2-yl]methyl]-2-methyl-propane-1-sulfonamide

Systemtic Name: N-[[6-[(4-methoxyphenyl)methylamino]-9-(oxan-2-yl)purin-2-yl]methyl]-2-methyl-propane-1-sulfonamide Openeye Name: N-[[6-[(4-methoxyphenyl)methylamino]-9-tetrahydropyran-2-yl-purin-2-yl]methyl]-2-methyl-propane-1-sulfonamide CAS Name: N-[[6-[(4-methoxyphenyl)methylamino]-9-(2-oxanyl)-2-purinyl]methyl]-2-methyl-1-propanesulfonamide IUPAC Name: N-[[6-[(4-methoxyphenyl)methylamino]-9-(oxan-2-yl)purin-2-yl]methyl]-2-methylpropane-1-sulfonamide Traditional Name: 2-methyl-N-[[6-(p-anisylamino)-9-tetrahydropyran-2-yl-purin-2-yl]methyl]propane-1-sulfonamide Formula: C23H32N6O4S MolecularWeight: 488.60298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CS(=O)(=O)NCC1=NC2=C(C(=N1)NCC3=CC=C(C=C3)OC)N=CN2C4CCCCO4

Isomeric SMILES

CC(C)CS(=O)(=O)NCC1=NC2=C(C(=N1)NCC3=CC=C(C=C3)OC)N=CN2C4CCCCO4

InChI

InChI=1S/C23H32N6O4S/c1-16(2)14-34(30,31)26-13-19-27-22(24-12-17-7-9-18(32-3)10-8-17)21-23(28-19)29(15-25-21)20-6-4-5-11-33-20/h7-10,15-16,20,26H,4-6,11-14H2,1-3H3,(H,24,27,28)