3-fluoranyl-4-methoxy-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3-fluoranyl-4-methoxy-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-fluoro-4-methoxy-benzamide CAS Name: 3-fluoro-4-methoxy-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-fluoro-4-methoxybenzamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-3-fluoro-4-methoxy-benzamide Formula: C17H14FN3O2S2 MolecularWeight: 375.440363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3)F

InChI

InChI=1S/C17H14FN3O2S2/c1-23-14-8-7-12(9-13(14)18)15(22)19-16-20-21-17(25-16)24-10-11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,19,20,22)