ethyl 3-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-4-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 3-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: ethyl 3-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-4-fluoro-benzothiophene-2-carboxylate CAS Name: 3-[[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-4-fluoro-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 3-[[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-4-fluoro-benzothiophene-2-carboxylic acid ethyl ester Formula: C16H16FN3O2S3 MolecularWeight: 397.510543

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NN=C(S1)SCC2=C(SC3=CC=CC(=C32)F)C(=O)OCC

Isomeric SMILES

CCNC1=NN=C(S1)SCC2=C(SC3=CC=CC(=C32)F)C(=O)OCC

InChI

InChI=1S/C16H16FN3O2S3/c1-3-18-15-19-20-16(25-15)23-8-9-12-10(17)6-5-7-11(12)24-13(9)14(21)22-4-2/h5-7H,3-4,8H2,1-2H3,(H,18,19)