ethyl 4-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]-7-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: ethyl 4-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]-7-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: ethyl 4-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-7-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)thio]-7-(trifluoromethyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]-7-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]thio]-7-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester Formula: C19H12F3N3O3S2 MolecularWeight: 451.44209

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=C(C=CC2=C1SC3=NN=C(O3)C4=CC=CS4)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CN=C2C=C(C=CC2=C1SC3=NN=C(O3)C4=CC=CS4)C(F)(F)F

InChI

InChI=1S/C19H12F3N3O3S2/c1-2-27-17(26)12-9-23-13-8-10(19(20,21)22)5-6-11(13)15(12)30-18-25-24-16(28-18)14-4-3-7-29-14/h3-9H,2H2,1H3