AC1OBNHI

2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide

Also Known As: (E)-2-((4-(4-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)-N'-(pyridin-3-ylmethylene)acetohydrazide|2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide|2-{[4-(4-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-pyridin-3-ylmethylidene]acetohydrazide|N-((1E)-2-(3-pyridyl)-1-azavinyl)-2-[4-(4-chlorophenyl)-5-(4-pyridyl)(1,2,4-tr iazol-3-ylthio)]acetamide

Molecular Formula	C21H16ClN7OS
Molecular Weight	449.08255 g/mol
LogP	3.6201
Topological Polar Surface Area	97.95 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	7
Exact Mass	449.08255
Monoisotopic Mass	449.08255
Heavy Atoms	31
Complexity	1181.601

Chemical Identifiers

CAS Number	613253-25-1
SMILES	C1=CC(=CN=C1)/C=N/NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC=NC=C4