methyl 2-[[1-(3-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[1-(3-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]carbonylamino]ethanoate Openeye Name: methyl 2-[[1-(3-fluorophenyl)-5-(2-thienyl)-1,2,4-triazole-3-carbonyl]amino]acetate CAS Name: 2-[[[1-(3-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[1-(3-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carbonyl]amino]acetate Traditional Name: 2-[[1-(3-fluorophenyl)-5-(2-thienyl)-1,2,4-triazole-3-carbonyl]amino]acetic acid methyl ester Formula: C16H13FN4O3S MolecularWeight: 360.362823

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C1=NN(C(=N1)C2=CC=CS2)C3=CC(=CC=C3)F

Isomeric SMILES

COC(=O)CNC(=O)C1=NN(C(=N1)C2=CC=CS2)C3=CC(=CC=C3)F

InChI

InChI=1S/C16H13FN4O3S/c1-24-13(22)9-18-16(23)14-19-15(12-6-3-7-25-12)21(20-14)11-5-2-4-10(17)8-11/h2-8H,9H2,1H3,(H,18,23)