N-ethyl-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-fluorophenyl)methyl]ethanamide

Systemtic Name: N-ethyl-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-fluorophenyl)methyl]ethanamide Openeye Name: N-ethyl-2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(3-fluorophenyl)methyl]acetamide CAS Name: N-ethyl-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-N-[(3-fluorophenyl)methyl]acetamide IUPAC Name: N-ethyl-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-fluorophenyl)methyl]acetamide Traditional Name: N-ethyl-2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(3-fluorobenzyl)acetamide Formula: C20H22FN5OS MolecularWeight: 399.484983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)N(CC)CC2=CC(=CC=C2)F)C3=CC=NC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)N(CC)CC2=CC(=CC=C2)F)C3=CC=NC=C3

InChI

InChI=1S/C20H22FN5OS/c1-3-25(13-15-6-5-7-17(21)12-15)18(27)14-28-20-24-23-19(26(20)4-2)16-8-10-22-11-9-16/h5-12H,3-4,13-14H2,1-2H3