4-chloranyl-3-(2-pyridin-2-ylsulfanylethanoylamino)benzoic acid

Systemtic Name: 4-chloranyl-3-(2-pyridin-2-ylsulfanylethanoylamino)benzoic acid Openeye Name: 4-chloro-3-[[2-(2-pyridylsulfanyl)acetyl]amino]benzoic acid CAS Name: 4-chloro-3-[[1-oxo-2-(2-pyridinylthio)ethyl]amino]benzoic acid IUPAC Name: 4-chloro-3-[(2-pyridin-2-ylsulfanylacetyl)amino]benzoic acid Traditional Name: 4-chloro-3-[[2-(2-pyridylthio)acetyl]amino]benzoic acid Formula: C14H11ClN2O3S MolecularWeight: 322.76674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)SCC(=O)NC2=C(C=CC(=C2)C(=O)O)Cl

Isomeric SMILES

C1=CC=NC(=C1)SCC(=O)NC2=C(C=CC(=C2)C(=O)O)Cl

InChI

InChI=1S/C14H11ClN2O3S/c15-10-5-4-9(14(19)20)7-11(10)17-12(18)8-21-13-3-1-2-6-16-13/h1-7H,8H2,(H,17,18)(H,19,20)