2-[[4-(2-fluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-phenethyl-1,3-oxazole-4-carboxamide

Systemtic Name: 2-[[4-(2-fluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-phenethyl-1,3-oxazole-4-carboxamide Openeye Name: 2-[[4-(2-fluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-phenethyl-oxazole-4-carboxamide CAS Name: 2-[[[4-(2-fluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]methyl]-N-phenethyl-4-oxazolecarboxamide IUPAC Name: 2-[[4-(2-fluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-phenethyl-1,3-oxazole-4-carboxamide Traditional Name: 2-[[[4-(2-fluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]methyl]-N-phenethyl-oxazole-4-carboxamide Formula: C27H22FN5O2S MolecularWeight: 499.559283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=COC(=N2)CSC3=NN=C(N3C4=CC=CC=C4F)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=COC(=N2)CSC3=NN=C(N3C4=CC=CC=C4F)C5=CC=CC=C5

InChI

InChI=1S/C27H22FN5O2S/c28-21-13-7-8-14-23(21)33-25(20-11-5-2-6-12-20)31-32-27(33)36-18-24-30-22(17-35-24)26(34)29-16-15-19-9-3-1-4-10-19/h1-14,17H,15-16,18H2,(H,29,34)