4-[2,6-bis(oxidanylidene)-1-propyl-3,7-dihydropurin-8-yl]-N-(2-hydroxyethyl)benzenesulfonamide

Systemtic Name: 4-[2,6-bis(oxidanylidene)-1-propyl-3,7-dihydropurin-8-yl]-N-(2-hydroxyethyl)benzenesulfonamide Openeye Name: 4-(2,6-dioxo-1-propyl-3,7-dihydropurin-8-yl)-N-(2-hydroxyethyl)benzenesulfonamide CAS Name: 4-(2,6-dioxo-1-propyl-3,7-dihydropurin-8-yl)-N-(2-hydroxyethyl)benzenesulfonamide IUPAC Name: 4-(2,6-dioxo-1-propyl-3,7-dihydropurin-8-yl)-N-(2-hydroxyethyl)benzenesulfonamide Traditional Name: 4-(2,6-diketo-1-propyl-3,7-dihydropurin-8-yl)-N-(2-hydroxyethyl)benzenesulfonamide Formula: C16H19N5O5S MolecularWeight: 393.41756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(NC1=O)N=C(N2)C3=CC=C(C=C3)S(=O)(=O)NCCO

Isomeric SMILES

CCCN1C(=O)C2=C(NC1=O)N=C(N2)C3=CC=C(C=C3)S(=O)(=O)NCCO

InChI

InChI=1S/C16H19N5O5S/c1-2-8-21-15(23)12-14(20-16(21)24)19-13(18-12)10-3-5-11(6-4-10)27(25,26)17-7-9-22/h3-6,17,22H,2,7-9H2,1H3,(H,18,19)(H,20,24)