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

Systemtic Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)-thiophen-2-yl-methyl]ethanamide Openeye Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)-(2-thienyl)methyl]acetamide CAS Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-[(4-fluorophenyl)-thiophen-2-ylmethyl]acetamide IUPAC Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)-thiophen-2-ylmethyl]acetamide Traditional Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-[(4-fluorophenyl)-(2-thienyl)methyl]acetamide Formula: C20H21FN4OS2 MolecularWeight: 416.535343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC(C2=CC=C(C=C2)F)C3=CC=CS3)C4CC4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC(C2=CC=C(C=C2)F)C3=CC=CS3)C4CC4

InChI

InChI=1S/C20H21FN4OS2/c1-2-25-19(14-5-6-14)23-24-20(25)28-12-17(26)22-18(16-4-3-11-27-16)13-7-9-15(21)10-8-13/h3-4,7-11,14,18H,2,5-6,12H2,1H3,(H,22,26)