2-azanyl-N-(2-methylphenyl)sulfonyl-6-oxidanylidene-3H-purine-9-carboxamide

Systemtic Name: 2-azanyl-N-(2-methylphenyl)sulfonyl-6-oxidanylidene-3H-purine-9-carboxamide Openeye Name: 2-amino-N-(o-tolylsulfonyl)-6-oxo-3H-purine-9-carboxamide CAS Name: 2-amino-N-(2-methylphenyl)sulfonyl-6-oxo-3H-purine-9-carboxamide IUPAC Name: 2-amino-N-(2-methylphenyl)sulfonyl-6-oxo-3H-purine-9-carboxamide Traditional Name: 2-amino-6-keto-N-(o-tolylsulfonyl)-3H-purine-9-carboxamide Formula: C13H12N6O4S MolecularWeight: 348.33718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)NC(=O)N2C=NC3=C2NC(=NC3=O)N

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)NC(=O)N2C=NC3=C2NC(=NC3=O)N

InChI

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