9-(4-aminophenyl)sulfonyl-3H-purine-2,6-dione

Systemtic Name: 9-(4-aminophenyl)sulfonyl-3H-purine-2,6-dione Openeye Name: 9-(4-aminophenyl)sulfonyl-3H-purine-2,6-dione CAS Name: 9-(4-aminophenyl)sulfonyl-3H-purine-2,6-dione IUPAC Name: 9-(4-aminophenyl)sulfonyl-3H-purine-2,6-dione Traditional Name: 9-sulfanilylxanthine Formula: C11H9N5O4S MolecularWeight: 307.28526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)S(=O)(=O)N2C=NC3=C2NC(=O)NC3=O

Isomeric SMILES

C1=CC(=CC=C1N)S(=O)(=O)N2C=NC3=C2NC(=O)NC3=O

InChI

InChI=1S/C11H9N5O4S/c12-6-1-3-7(4-2-6)21(19,20)16-5-13-8-9(16)14-11(18)15-10(8)17/h1-5H,12H2,(H2,14,15,17,18)