2-(6-acetamidopyridin-3-yl)sulfanylbenzoate

Systemtic Name: 2-(6-acetamidopyridin-3-yl)sulfanylbenzoate Openeye Name: 2-[(6-acetamido-3-pyridyl)sulfanyl]benzoate CAS Name: 2-[(6-acetamido-3-pyridinyl)thio]benzoate IUPAC Name: 2-(6-acetamidopyridin-3-yl)sulfanylbenzoate Traditional Name: 2-[(6-acetamido-3-pyridyl)thio]benzoate Formula: C14H11N2O3S- MolecularWeight: 287.31374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=C(C=C1)SC2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

CC(=O)NC1=NC=C(C=C1)SC2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C14H12N2O3S/c1-9(17)16-13-7-6-10(8-15-13)20-12-5-3-2-4-11(12)14(18)19/h2-8H,1H3,(H,18,19)(H,15,16,17)/p-1