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

Systemtic Name: 2-[[5-(2-fluorophenyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(3-methoxyphenyl)methyl]ethanamide Openeye Name: 2-[[4-benzyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(3-methoxyphenyl)methyl]acetamide CAS Name: 2-[[5-(2-fluorophenyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-N-[(3-methoxyphenyl)methyl]acetamide IUPAC Name: 2-[[4-benzyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(3-methoxyphenyl)methyl]acetamide Traditional Name: 2-[[4-benzyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]-N-m-anisyl-acetamide Formula: C25H23FN4O2S MolecularWeight: 462.539123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=CC=C4F

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=CC=C4F

InChI

InChI=1S/C25H23FN4O2S/c1-32-20-11-7-10-19(14-20)15-27-23(31)17-33-25-29-28-24(21-12-5-6-13-22(21)26)30(25)16-18-8-3-2-4-9-18/h2-14H,15-17H2,1H3,(H,27,31)