4-(7H-purin-6-ylamino)benzenesulfonic acid

Systemtic Name: 4-(7H-purin-6-ylamino)benzenesulfonic acid Openeye Name: 4-(7H-purin-6-ylamino)benzenesulfonic acid CAS Name: 4-(7H-purin-6-ylamino)benzenesulfonic acid IUPAC Name: 4-(7H-purin-6-ylamino)benzenesulfonic acid Traditional Name: 4-(7H-purin-6-ylamino)besylic acid Formula: C11H9N5O3S MolecularWeight: 291.28586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC=NC3=C2NC=N3)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1NC2=NC=NC3=C2NC=N3)S(=O)(=O)O

InChI

InChI=1S/C11H9N5O3S/c17-20(18,19)8-3-1-7(2-4-8)16-11-9-10(13-5-12-9)14-6-15-11/h1-6H,(H,17,18,19)(H2,12,13,14,15,16)