2-(1,3-benzothiazol-2-yl)-4-(1-morpholin-4-ylethylidene)-5-(trifluoromethyl)pyrazol-3-one

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-4-(1-morpholin-4-ylethylidene)-5-(trifluoromethyl)pyrazol-3-one Openeye Name: 2-(1,3-benzothiazol-2-yl)-4-(1-morpholinoethylidene)-5-(trifluoromethyl)pyrazol-3-one CAS Name: 2-(1,3-benzothiazol-2-yl)-4-[1-(4-morpholinyl)ethylidene]-5-(trifluoromethyl)-3-pyrazolone IUPAC Name: 2-(1,3-benzothiazol-2-yl)-4-(1-morpholin-4-ylethylidene)-5-(trifluoromethyl)pyrazol-3-one Traditional Name: 2-(1,3-benzothiazol-2-yl)-4-(1-morpholinoethylidene)-5-(trifluoromethyl)-2-pyrazolin-3-one Formula: C17H15F3N4O2S MolecularWeight: 396.38681

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C(F)(F)F)N4CCOCC4

Isomeric SMILES

CC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C(F)(F)F)N4CCOCC4

InChI

InChI=1S/C17H15F3N4O2S/c1-10(23-6-8-26-9-7-23)13-14(17(18,19)20)22-24(15(13)25)16-21-11-4-2-3-5-12(11)27-16/h2-5H,6-9H2,1H3