2-fluoranyl-6-(2-oxidanylideneazepan-3-yl)oxy-benzenecarbothioamide

Systemtic Name: 2-fluoranyl-6-(2-oxidanylideneazepan-3-yl)oxy-benzenecarbothioamide Openeye Name: 2-fluoro-6-(2-oxoazepan-3-yl)oxy-benzenecarbothioamide CAS Name: 2-fluoro-6-[(2-oxo-3-azepanyl)oxy]benzenecarbothioamide IUPAC Name: 2-fluoro-6-(2-oxoazepan-3-yl)oxybenzenecarbothioamide Traditional Name: 2-fluoro-6-(2-ketoazepan-3-yl)oxy-thiobenzamide Formula: C13H15FN2O2S MolecularWeight: 282.333803

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)OC2=C(C(=CC=C2)F)C(=S)N

Isomeric SMILES

C1CCNC(=O)C(C1)OC2=C(C(=CC=C2)F)C(=S)N

InChI

InChI=1S/C13H15FN2O2S/c14-8-4-3-6-9(11(8)12(15)19)18-10-5-1-2-7-16-13(10)17/h3-4,6,10H,1-2,5,7H2,(H2,15,19)(H,16,17)