N-[3-[6-oxidanylidene-2-(2-propoxyphenyl)-3H-purin-9-yl]nonan-2-yl]benzenesulfonamide

Systemtic Name: N-[3-[6-oxidanylidene-2-(2-propoxyphenyl)-3H-purin-9-yl]nonan-2-yl]benzenesulfonamide Openeye Name: N-[1-methyl-2-[6-oxo-2-(2-propoxyphenyl)-3H-purin-9-yl]octyl]benzenesulfonamide CAS Name: N-[3-[6-oxo-2-(2-propoxyphenyl)-3H-purin-9-yl]nonan-2-yl]benzenesulfonamide IUPAC Name: N-[3-[6-oxo-2-(2-propoxyphenyl)-3H-purin-9-yl]nonan-2-yl]benzenesulfonamide Traditional Name: N-[2-[6-keto-2-(2-propoxyphenyl)-3H-purin-9-yl]-1-methyl-octyl]benzenesulfonamide Formula: C29H37N5O4S MolecularWeight: 551.70018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(C)NS(=O)(=O)C1=CC=CC=C1)N2C=NC3=C2NC(=NC3=O)C4=CC=CC=C4OCCC

Isomeric SMILES

CCCCCCC(C(C)NS(=O)(=O)C1=CC=CC=C1)N2C=NC3=C2NC(=NC3=O)C4=CC=CC=C4OCCC

InChI

InChI=1S/C29H37N5O4S/c1-4-6-7-11-17-24(21(3)33-39(36,37)22-14-9-8-10-15-22)34-20-30-26-28(34)31-27(32-29(26)35)23-16-12-13-18-25(23)38-19-5-2/h8-10,12-16,18,20-21,24,33H,4-7,11,17,19H2,1-3H3,(H,31,32,35)