4-(azepan-1-yl)-3-fluoranyl-benzenecarbothioamide

Systemtic Name: 4-(azepan-1-yl)-3-fluoranyl-benzenecarbothioamide Openeye Name: 4-(azepan-1-yl)-3-fluoro-benzenecarbothioamide CAS Name: 4-(1-azepanyl)-3-fluorobenzenecarbothioamide IUPAC Name: 4-(azepan-1-yl)-3-fluorobenzenecarbothioamide Traditional Name: 4-(azepan-1-yl)-3-fluoro-thiobenzamide Formula: C13H17FN2S MolecularWeight: 252.350883

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)C(=S)N)F

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)C(=S)N)F

InChI

InChI=1S/C13H17FN2S/c14-11-9-10(13(15)17)5-6-12(11)16-7-3-1-2-4-8-16/h5-6,9H,1-4,7-8H2,(H2,15,17)