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

Systemtic Name: 2-[[4-(2-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-phenethyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[4-(2-fluorophenyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-phenethyl-thiazole-4-carboxamide CAS Name: 2-[[[4-(2-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]methyl]-N-phenethyl-4-thiazolecarboxamide IUPAC Name: 2-[[4-(2-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-phenethyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[[4-(2-fluorophenyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]-N-phenethyl-thiazole-4-carboxamide Formula: C26H21FN6OS2 MolecularWeight: 516.612943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H21FN6OS2/c27-20-8-4-5-9-22(20)33-24(19-11-13-28-14-12-19)31-32-26(33)36-17-23-30-21(16-35-23)25(34)29-15-10-18-6-2-1-3-7-18/h1-9,11-14,16H,10,15,17H2,(H,29,34)