AC1OAPMK

2-[[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(4-nitrophenyl)methylideneamino]acetamide

Also Known As: 2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(4-nitrophenyl)methylidene]acetohydrazide|(E)-2-((5-(4-(tert-butyl)phenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide|2-[[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(4-nitrophenyl)methylideneamino]acetamide|N-[(1E)-2-(4-nitrophenyl)-1-azavinyl]-2-{5-[4-(tert-butyl)phenyl]-4-(4-methoxy phenyl)(1,2,4-triazol-3-ylthio)}acetamide

Molecular Formula	C28H28N6O4S
Molecular Weight	544.1893 g/mol
LogP	5.391
Topological Polar Surface Area	124.54 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	8
Rotatable Bonds	9
Exact Mass	544.1893
Monoisotopic Mass	544.1893
Heavy Atoms	39
Complexity	1474.7297

Chemical Identifiers

CAS Number	487019-65-8
SMILES	CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)OC)SCC(=O)N/N=C/C4=CC=C(C=C4)[N+](=O)[O-]