ethyl 4-fluoranyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 4-fluoranyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-1-benzothiophene-2-carboxylate Openeye Name: ethyl 4-fluoro-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-[(1,3,4-thiadiazol-2-ylthio)methyl]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-fluoro-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-[(1,3,4-thiadiazol-2-ylthio)methyl]benzothiophene-2-carboxylic acid ethyl ester Formula: C14H11FN2O2S3 MolecularWeight: 354.442743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CSC3=NN=CS3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CSC3=NN=CS3

InChI

InChI=1S/C14H11FN2O2S3/c1-2-19-13(18)12-8(6-20-14-17-16-7-21-14)11-9(15)4-3-5-10(11)22-12/h3-5,7H,2,6H2,1H3