N-(3-cyanothiophen-2-yl)-2-[[5-[1-(4-fluoranylphenoxy)ethyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-2-[[5-[1-(4-fluoranylphenoxy)ethyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-[1-(4-fluorophenoxy)ethyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(3-cyano-2-thienyl)acetamide CAS Name: N-(3-cyano-2-thiophenyl)-2-[[5-[1-(4-fluorophenoxy)ethyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(3-cyanothiophen-2-yl)-2-[[5-[1-(4-fluorophenoxy)ethyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-[1-(4-fluorophenoxy)ethyl]-1,2,4-triazol-3-yl]thio]-N-(3-cyano-2-thienyl)acetamide Formula: C20H18FN5O2S2 MolecularWeight: 443.517623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(N1CC=C)SCC(=O)NC2=C(C=CS2)C#N)OC3=CC=C(C=C3)F

Isomeric SMILES

CC(C1=NN=C(N1CC=C)SCC(=O)NC2=C(C=CS2)C#N)OC3=CC=C(C=C3)F

InChI

InChI=1S/C20H18FN5O2S2/c1-3-9-26-18(13(2)28-16-6-4-15(21)5-7-16)24-25-20(26)30-12-17(27)23-19-14(11-22)8-10-29-19/h3-8,10,13H,1,9,12H2,2H3,(H,23,27)