N-[3-[[6-(2-hydroxyethylamino)-7H-purin-2-yl]amino]phenyl]methanesulfonamide

Systemtic Name: N-[3-[[6-(2-hydroxyethylamino)-7H-purin-2-yl]amino]phenyl]methanesulfonamide Openeye Name: N-[3-[[6-(2-hydroxyethylamino)-7H-purin-2-yl]amino]phenyl]methanesulfonamide CAS Name: N-[3-[[6-(2-hydroxyethylamino)-7H-purin-2-yl]amino]phenyl]methanesulfonamide IUPAC Name: N-[3-[[6-(2-hydroxyethylamino)-7H-purin-2-yl]amino]phenyl]methanesulfonamide Traditional Name: N-[3-[[6-(2-hydroxyethylamino)-7H-purin-2-yl]amino]phenyl]methanesulfonamide Formula: C14H17N7O3S MolecularWeight: 363.39488

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC(=C1)NC2=NC3=C(C(=N2)NCCO)NC=N3

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC(=C1)NC2=NC3=C(C(=N2)NCCO)NC=N3

InChI

InChI=1S/C14H17N7O3S/c1-25(23,24)21-10-4-2-3-9(7-10)18-14-19-12(15-5-6-22)11-13(20-14)17-8-16-11/h2-4,7-8,21-22H,5-6H2,1H3,(H3,15,16,17,18,19,20)