N-(4-bromophenyl)-6-sulfanylidene-3H-purine-9-sulfonamide

Systemtic Name: N-(4-bromophenyl)-6-sulfanylidene-3H-purine-9-sulfonamide Openeye Name: N-(4-bromophenyl)-6-thioxo-3H-purine-9-sulfonamide CAS Name: N-(4-bromophenyl)-6-sulfanylidene-3H-purine-9-sulfonamide IUPAC Name: N-(4-bromophenyl)-6-sulfanylidene-3H-purine-9-sulfonamide Traditional Name: N-(4-bromophenyl)-6-thioxo-3H-purine-9-sulfonamide Formula: C11H8BrN5O2S2 MolecularWeight: 386.24752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NS(=O)(=O)N2C=NC3=C2NC=NC3=S)Br

Isomeric SMILES

C1=CC(=CC=C1NS(=O)(=O)N2C=NC3=C2NC=NC3=S)Br

InChI

InChI=1S/C11H8BrN5O2S2/c12-7-1-3-8(4-2-7)16-21(18,19)17-6-15-9-10(17)13-5-14-11(9)20/h1-6,16H,(H,13,14,20)