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

Systemtic Name: 2-[[5-[(4-fluoranylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-ethanamide Openeye Name: 2-[[4-allyl-5-[(4-fluorophenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-acetamide CAS Name: 2-[[5-[(4-fluorophenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-N-propylacetamide IUPAC Name: 2-[[5-[(4-fluorophenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-propylacetamide Traditional Name: 2-[[4-allyl-5-[(4-fluorophenoxy)methyl]-1,2,4-triazol-3-yl]thio]-N-propyl-acetamide Formula: C17H21FN4O2S MolecularWeight: 364.437643

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CSC1=NN=C(N1CC=C)COC2=CC=C(C=C2)F

Isomeric SMILES

CCCNC(=O)CSC1=NN=C(N1CC=C)COC2=CC=C(C=C2)F

InChI

InChI=1S/C17H21FN4O2S/c1-3-9-19-16(23)12-25-17-21-20-15(22(17)10-4-2)11-24-14-7-5-13(18)6-8-14/h4-8H,2-3,9-12H2,1H3,(H,19,23)