N-[4-[(6-oxidanylidene-3,7-dihydropurin-2-yl)sulfamoyl]phenyl]ethanamide

Systemtic Name: N-[4-[(6-oxidanylidene-3,7-dihydropurin-2-yl)sulfamoyl]phenyl]ethanamide Openeye Name: N-[4-[(6-oxo-3,7-dihydropurin-2-yl)sulfamoyl]phenyl]acetamide CAS Name: N-[4-[(6-oxo-3,7-dihydropurin-2-yl)sulfamoyl]phenyl]acetamide IUPAC Name: N-[4-[(6-oxo-3,7-dihydropurin-2-yl)sulfamoyl]phenyl]acetamide Traditional Name: N-[4-[(6-keto-3,7-dihydropurin-2-yl)sulfamoyl]phenyl]acetamide Formula: C13H12N6O4S MolecularWeight: 348.33718

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=O)C3=C(N2)N=CN3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=O)C3=C(N2)N=CN3

InChI

InChI=1S/C13H12N6O4S/c1-7(20)16-8-2-4-9(5-3-8)24(22,23)19-13-17-11-10(12(21)18-13)14-6-15-11/h2-6H,1H3,(H,16,20)(H3,14,15,17,18,19,21)