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

Systemtic Name: ethyl 3-[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: ethyl 3-[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-4-fluoro-benzothiophene-2-carboxylate CAS Name: 3-[[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)thio]methyl]-4-fluoro-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 3-[[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)thio]methyl]-4-fluoro-benzothiophene-2-carboxylic acid ethyl ester Formula: C20H21FN2O3S2 MolecularWeight: 420.520743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CSC3=NN=C(O3)C4CCCCC4

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CSC3=NN=C(O3)C4CCCCC4

InChI

InChI=1S/C20H21FN2O3S2/c1-2-25-19(24)17-13(16-14(21)9-6-10-15(16)28-17)11-27-20-23-22-18(26-20)12-7-4-3-5-8-12/h6,9-10,12H,2-5,7-8,11H2,1H3