4-[2-[(6-aminopurin-9-yl)methoxy]ethylcarbamoyl]benzenesulfonyl fluoride

Systemtic Name: 4-[2-[(6-aminopurin-9-yl)methoxy]ethylcarbamoyl]benzenesulfonyl fluoride Openeye Name: 4-[2-[(6-aminopurin-9-yl)methoxy]ethylcarbamoyl]benzenesulfonyl fluoride CAS Name: 4-[[2-[(6-aminopurin-9-yl)methoxy]ethylamino]-oxomethyl]benzenesulfonyl fluoride IUPAC Name: 4-[2-[(6-aminopurin-9-yl)methoxy]ethylcarbamoyl]benzenesulfonyl fluoride Traditional Name: 4-[2-(adenin-9-ylmethoxy)ethylcarbamoyl]benzenesulfonyl fluoride Formula: C15H15FN6O4S MolecularWeight: 394.380803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCOCN2C=NC3=C2N=CN=C3N)S(=O)(=O)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCOCN2C=NC3=C2N=CN=C3N)S(=O)(=O)F

InChI

InChI=1S/C15H15FN6O4S/c16-27(24,25)11-3-1-10(2-4-11)15(23)18-5-6-26-9-22-8-21-12-13(17)19-7-20-14(12)22/h1-4,7-8H,5-6,9H2,(H,18,23)(H2,17,19,20)