N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-3-fluoranyl-benzamide

Systemtic Name: N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-3-fluoranyl-benzamide Openeye Name: 3-fluoro-N-(5-sec-butylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: N-[5-(butan-2-ylthio)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide IUPAC Name: N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-3-fluorobenzamide Traditional Name: 3-fluoro-N-[5-(sec-butylthio)-1,3,4-thiadiazol-2-yl]benzamide Formula: C13H14FN3OS2 MolecularWeight: 311.398163

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)F

Isomeric SMILES

CCC(C)SC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)F

InChI

InChI=1S/C13H14FN3OS2/c1-3-8(2)19-13-17-16-12(20-13)15-11(18)9-5-4-6-10(14)7-9/h4-8H,3H2,1-2H3,(H,15,16,18)