4-(4-bromophenyl)sulfanylpyridine-3-sulfonic acid

Systemtic Name: 4-(4-bromophenyl)sulfanylpyridine-3-sulfonic acid Openeye Name: 4-(4-bromophenyl)sulfanylpyridine-3-sulfonic acid CAS Name: 4-[(4-bromophenyl)thio]-3-pyridinesulfonic acid IUPAC Name: 4-(4-bromophenyl)sulfanylpyridine-3-sulfonic acid Traditional Name: 4-[(4-bromophenyl)thio]pyridine-3-sulfonic acid Formula: C11H8BrNO3S2 MolecularWeight: 346.22012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SC2=C(C=NC=C2)S(=O)(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1SC2=C(C=NC=C2)S(=O)(=O)O)Br

InChI

InChI=1S/C11H8BrNO3S2/c12-8-1-3-9(4-2-8)17-10-5-6-13-7-11(10)18(14,15)16/h1-7H,(H,14,15,16)