N-[3-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]-1-(4-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-[3-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]-1-(4-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Openeye Name: N-[3-(2-amino-2-oxo-ethoxy)phenyl]-1-(4-fluorophenyl)-5-(2-thienyl)-1,2,4-triazole-3-carboxamide CAS Name: N-[3-(2-amino-2-oxoethoxy)phenyl]-1-(4-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide IUPAC Name: N-[3-(2-amino-2-oxoethoxy)phenyl]-1-(4-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Traditional Name: N-[3-(2-amino-2-keto-ethoxy)phenyl]-1-(4-fluorophenyl)-5-(2-thienyl)-1,2,4-triazole-3-carboxamide Formula: C21H16FN5O3S MolecularWeight: 437.446843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC(=O)N)NC(=O)C2=NN(C(=N2)C3=CC=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC(=CC(=C1)OCC(=O)N)NC(=O)C2=NN(C(=N2)C3=CC=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H16FN5O3S/c22-13-6-8-15(9-7-13)27-20(17-5-2-10-31-17)25-19(26-27)21(29)24-14-3-1-4-16(11-14)30-12-18(23)28/h1-11H,12H2,(H2,23,28)(H,24,29)