N-(3-chloranyl-4-fluoranyl-phenyl)-2-(5-nitropyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-2-(5-nitropyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-2-[(5-nitro-2-pyridyl)sulfanyl]acetamide CAS Name: N-(3-chloro-4-fluorophenyl)-2-[(5-nitro-2-pyridinyl)thio]acetamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-2-(5-nitropyridin-2-yl)sulfanylacetamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-2-[(5-nitro-2-pyridyl)thio]acetamide Formula: C13H9ClFN3O3S MolecularWeight: 341.745263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)CSC2=NC=C(C=C2)[N+](=O)[O-])Cl)F

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)CSC2=NC=C(C=C2)[N+](=O)[O-])Cl)F

InChI

InChI=1S/C13H9ClFN3O3S/c14-10-5-8(1-3-11(10)15)17-12(19)7-22-13-4-2-9(6-16-13)18(20)21/h1-6H,7H2,(H,17,19)