AC1LYX0M

(2Z)-6-benzyl-2-[[3-(3-nitrophenyl)-1-phenylpyrazol-4-yl]methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione

Also Known As: CBMicro_003035|BIM-0003108.P001|(2Z)-6-benzyl-2-[[3-(3-nitrophenyl)-1-phenylpyrazol-4-yl]methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione|(2Z)-6-benzyl-2-{[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione|(Z)-6-benzyl-2-((3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-2H-thiazolo[3,2-b][1,2,4]triazine-3,7-dione|6-benzyl-2-{[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione

Molecular Formula	C28H18N6O4S
Molecular Weight	534.111 g/mol
LogP	3.4106
Topological Polar Surface Area	125.29 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	8
Rotatable Bonds	6
Exact Mass	534.111
Monoisotopic Mass	534.111
Heavy Atoms	39
Complexity	2016.8805

Chemical Identifiers

CAS Number	313273-07-3
SMILES	C1=CC=C(C=C1)CC2=NN3C(=O)/C(=C/C4=CN(N=C4C5=CC(=CC=C5)[N+](=O)[O-])C6=CC=CC=C6)/SC3=NC2=O