N-(phenylmethyl)-5H-purine-6-sulfonamide

Systemtic Name: N-(phenylmethyl)-5H-purine-6-sulfonamide Openeye Name: N-benzyl-5H-purine-6-sulfonamide CAS Name: N-(phenylmethyl)-5H-purine-6-sulfonamide IUPAC Name: N-benzyl-5H-purine-6-sulfonamide Traditional Name: N-benzyl-5H-purine-6-sulfonamide Formula: C12H11N5O2S MolecularWeight: 289.31304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNS(=O)(=O)C2=NC=NC3=NC=NC32

Isomeric SMILES

C1=CC=C(C=C1)CNS(=O)(=O)C2=NC=NC3=NC=NC32

InChI

InChI=1S/C12H11N5O2S/c18-20(19,17-6-9-4-2-1-3-5-9)12-10-11(14-7-13-10)15-8-16-12/h1-5,7-8,10,17H,6H2