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

Systemtic Name: N-[3-[[6-(2-pyridin-2-ylethylamino)-7H-purin-2-yl]amino]phenyl]methanesulfonamide Openeye Name: N-[3-[[6-[2-(2-pyridyl)ethylamino]-7H-purin-2-yl]amino]phenyl]methanesulfonamide CAS Name: N-[3-[[6-[2-(2-pyridinyl)ethylamino]-7H-purin-2-yl]amino]phenyl]methanesulfonamide IUPAC Name: N-[3-[[6-(2-pyridin-2-ylethylamino)-7H-purin-2-yl]amino]phenyl]methanesulfonamide Traditional Name: N-[3-[[6-[2-(2-pyridyl)ethylamino]-7H-purin-2-yl]amino]phenyl]methanesulfonamide Formula: C19H20N8O2S MolecularWeight: 424.4795

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC(=C1)NC2=NC3=C(C(=N2)NCCC4=CC=CC=N4)NC=N3

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC(=C1)NC2=NC3=C(C(=N2)NCCC4=CC=CC=N4)NC=N3

InChI

InChI=1S/C19H20N8O2S/c1-30(28,29)27-15-7-4-6-14(11-15)24-19-25-17(16-18(26-19)23-12-22-16)21-10-8-13-5-2-3-9-20-13/h2-7,9,11-12,27H,8,10H2,1H3,(H3,21,22,23,24,25,26)