AC1NSY3W

2-(1,3-benzothiazol-2-yl)-4-(oxolan-2-ylmethyliminomethyl)-5-(trifluoromethyl)-1H-pyrazol-3-one

Also Known As: CBMicro_048995|BIM-0049126.P001|AB00091408-01|AG-664/14315005|AK-968/37053144|(4Z)-2-(1,3-benzothiazol-2-yl)-4-[(oxolan-2-ylmethylamino)methylidene]-5-(trifluoromethyl)pyrazol-3-one|(E)-2-(benzo[d]thiazol-2-yl)-4-((((tetrahydrofuran-2-yl)methyl)imino)methyl)-5-(trifluoromethyl)-1H-pyrazol-3(2H)-one|1-benzothiazol-2-yl-4-{[(oxolan-2-ylmethyl)amino]methylene}-3-(trifluoromethyl )-1,2-diazolin-5-one|2-(1,3-benzothiazol-2-yl)-4-[(oxolan-2-ylmethylamino)methylidene]-5-(trifluoromethyl)pyrazol-3-one|2-(1,3-benzothiazol-2-yl)-4-{(E)-[(tetrahydrofuran-2-ylmethyl)imino]methyl}-5-(trifluoromethyl)-1,2-dihydro-3H-pyrazol-3-one|2-(1,3-benzothiazol-2-yl)-4-{[(tetrahydro-2-furanylmethyl)imino]methyl}-5-(trifluoromethyl)-1,2-dihydro-3H-pyrazol-3-one

Molecular Formula	C17H15F3N4O2S
Molecular Weight	396.0868 g/mol
LogP	3.392
Topological Polar Surface Area	72.27 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	396.0868
Monoisotopic Mass	396.0868
Heavy Atoms	27
Complexity	1011.54706

Chemical Identifiers

CAS Number	354543-22-9
SMILES	C1CC(OC1)CN=CC2=C(NN(C2=O)C3=NC4=CC=CC=C4S3)C(F)(F)F