N-[3-[[8-bromanyl-6-(dimethylamino)purin-9-yl]methyl]phenyl]methanesulfonamide

Systemtic Name: N-[3-[[8-bromanyl-6-(dimethylamino)purin-9-yl]methyl]phenyl]methanesulfonamide Openeye Name: N-[3-[[8-bromo-6-(dimethylamino)purin-9-yl]methyl]phenyl]methanesulfonamide CAS Name: N-[3-[[8-bromo-6-(dimethylamino)-9-purinyl]methyl]phenyl]methanesulfonamide IUPAC Name: N-[3-[[8-bromo-6-(dimethylamino)purin-9-yl]methyl]phenyl]methanesulfonamide Traditional Name: N-[3-[[8-bromo-6-(dimethylamino)purin-9-yl]methyl]phenyl]methanesulfonamide Formula: C15H17BrN6O2S MolecularWeight: 425.30348

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=NC2=C1N=C(N2CC3=CC(=CC=C3)NS(=O)(=O)C)Br

Isomeric SMILES

CN(C)C1=NC=NC2=C1N=C(N2CC3=CC(=CC=C3)NS(=O)(=O)C)Br

InChI

InChI=1S/C15H17BrN6O2S/c1-21(2)13-12-14(18-9-17-13)22(15(16)19-12)8-10-5-4-6-11(7-10)20-25(3,23)24/h4-7,9,20H,8H2,1-3H3