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

Systemtic Name: N-butyl-2-[[5-[(2-fluoranylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-[(2-fluorophenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-butyl-acetamide CAS Name: N-butyl-2-[[5-[(2-fluorophenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-butyl-2-[[5-[(2-fluorophenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-[(2-fluorophenoxy)methyl]-1,2,4-triazol-3-yl]thio]-N-butyl-acetamide Formula: C18H23FN4O2S MolecularWeight: 378.464223

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSC1=NN=C(N1CC=C)COC2=CC=CC=C2F

Isomeric SMILES

CCCCNC(=O)CSC1=NN=C(N1CC=C)COC2=CC=CC=C2F

InChI

InChI=1S/C18H23FN4O2S/c1-3-5-10-20-17(24)13-26-18-22-21-16(23(18)11-4-2)12-25-15-9-7-6-8-14(15)19/h4,6-9H,2-3,5,10-13H2,1H3,(H,20,24)