2-[(6-azanyl-7H-purin-2-yl)carbonyl]benzenesulfonyl fluoride

Systemtic Name: 2-[(6-azanyl-7H-purin-2-yl)carbonyl]benzenesulfonyl fluoride Openeye Name: 2-(6-amino-7H-purine-2-carbonyl)benzenesulfonyl fluoride CAS Name: 2-[(6-amino-7H-purin-2-yl)-oxomethyl]benzenesulfonyl fluoride IUPAC Name: 2-(6-amino-7H-purine-2-carbonyl)benzenesulfonyl fluoride Traditional Name: 2-(6-amino-7H-purine-2-carbonyl)benzenesulfonyl fluoride Formula: C12H8FN5O3S MolecularWeight: 321.287023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)C2=NC3=C(C(=N2)N)NC=N3)S(=O)(=O)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)C2=NC3=C(C(=N2)N)NC=N3)S(=O)(=O)F

InChI

InChI=1S/C12H8FN5O3S/c13-22(20,21)7-4-2-1-3-6(7)9(19)12-17-10(14)8-11(18-12)16-5-15-8/h1-5H,(H3,14,15,16,17,18)