N-(3-ethylpent-1-yn-3-yl)-1-(4-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-(3-ethylpent-1-yn-3-yl)-1-(4-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Openeye Name: N-(1,1-diethylprop-2-ynyl)-1-(4-fluorophenyl)-5-(2-thienyl)-1,2,4-triazole-3-carboxamide CAS Name: N-(3-ethylpent-1-yn-3-yl)-1-(4-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide IUPAC Name: N-(3-ethylpent-1-yn-3-yl)-1-(4-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Traditional Name: N-(1,1-diethylprop-2-ynyl)-1-(4-fluorophenyl)-5-(2-thienyl)-1,2,4-triazole-3-carboxamide Formula: C20H19FN4OS MolecularWeight: 382.454463

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)C1=NN(C(=N1)C2=CC=CS2)C3=CC=C(C=C3)F

Isomeric SMILES

CCC(CC)(C#C)NC(=O)C1=NN(C(=N1)C2=CC=CS2)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H19FN4OS/c1-4-20(5-2,6-3)23-19(26)17-22-18(16-8-7-13-27-16)25(24-17)15-11-9-14(21)10-12-15/h1,7-13H,5-6H2,2-3H3,(H,23,26)