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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)SC1=NN=C(N1CC=C)COC2=CC=CC=C2F

Isomeric SMILES

CCCNC(=O)C(C)SC1=NN=C(N1CC=C)COC2=CC=CC=C2F

InChI

InChI=1S/C18H23FN4O2S/c1-4-10-20-17(24)13(3)26-18-22-21-16(23(18)11-5-2)12-25-15-9-7-6-8-14(15)19/h5-9,13H,2,4,10-12H2,1,3H3,(H,20,24)