2-[[4-(2-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-propan-2-yl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[4-(2-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-propan-2-yl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[4-(2-fluorophenyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-isopropyl-thiazole-4-carboxamide CAS Name: 2-[[[4-(2-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]methyl]-N-propan-2-yl-4-thiazolecarboxamide IUPAC Name: 2-[[4-(2-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-propan-2-yl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[[4-(2-fluorophenyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]-N-isopropyl-thiazole-4-carboxamide Formula: C21H19FN6OS2 MolecularWeight: 454.543563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CSC(=N1)CSC2=NN=C(N2C3=CC=CC=C3F)C4=CC=NC=C4

Isomeric SMILES

CC(C)NC(=O)C1=CSC(=N1)CSC2=NN=C(N2C3=CC=CC=C3F)C4=CC=NC=C4

InChI

InChI=1S/C21H19FN6OS2/c1-13(2)24-20(29)16-11-30-18(25-16)12-31-21-27-26-19(14-7-9-23-10-8-14)28(21)17-6-4-3-5-15(17)22/h3-11,13H,12H2,1-2H3,(H,24,29)