N-ethyl-4-[6-oxidanylidene-7-(phenylmethyl)-3H-purin-2-yl]benzenesulfonamide

Systemtic Name: N-ethyl-4-[6-oxidanylidene-7-(phenylmethyl)-3H-purin-2-yl]benzenesulfonamide Openeye Name: 4-(7-benzyl-6-oxo-3H-purin-2-yl)-N-ethyl-benzenesulfonamide CAS Name: N-ethyl-4-[6-oxo-7-(phenylmethyl)-3H-purin-2-yl]benzenesulfonamide IUPAC Name: 4-(7-benzyl-6-oxo-3H-purin-2-yl)-N-ethylbenzenesulfonamide Traditional Name: 4-(7-benzyl-6-keto-3H-purin-2-yl)-N-ethyl-benzenesulfonamide Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

CCNS(=O)(=O)C1=CC=C(C=C1)C2=NC(=O)C3=C(N2)N=CN3CC4=CC=CC=C4

Isomeric SMILES

CCNS(=O)(=O)C1=CC=C(C=C1)C2=NC(=O)C3=C(N2)N=CN3CC4=CC=CC=C4

InChI

InChI=1S/C20H19N5O3S/c1-2-22-29(27,28)16-10-8-15(9-11-16)18-23-19-17(20(26)24-18)25(13-21-19)12-14-6-4-3-5-7-14/h3-11,13,22H,2,12H2,1H3,(H,23,24,26)