2-(4-bromophenyl)sulfanylpyridine-3-carboxylate

Systemtic Name: 2-(4-bromophenyl)sulfanylpyridine-3-carboxylate Openeye Name: 2-(4-bromophenyl)sulfanylpyridine-3-carboxylate CAS Name: 2-[(4-bromophenyl)thio]-3-pyridinecarboxylate IUPAC Name: 2-(4-bromophenyl)sulfanylpyridine-3-carboxylate Traditional Name: 2-[(4-bromophenyl)thio]nicotinate Formula: C12H7BrNO2S- MolecularWeight: 309.15848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SC2=CC=C(C=C2)Br)C(=O)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)SC2=CC=C(C=C2)Br)C(=O)[O-]

InChI

InChI=1S/C12H8BrNO2S/c13-8-3-5-9(6-4-8)17-11-10(12(15)16)2-1-7-14-11/h1-7H,(H,15,16)/p-1