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

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-4-(1-ethoxyethylidene)-5-(trifluoromethyl)pyrazol-3-one Openeye Name: 2-(1,3-benzothiazol-2-yl)-4-(1-ethoxyethylidene)-5-(trifluoromethyl)pyrazol-3-one CAS Name: 2-(1,3-benzothiazol-2-yl)-4-(1-ethoxyethylidene)-5-(trifluoromethyl)-3-pyrazolone IUPAC Name: 2-(1,3-benzothiazol-2-yl)-4-(1-ethoxyethylidene)-5-(trifluoromethyl)pyrazol-3-one Traditional Name: 2-(1,3-benzothiazol-2-yl)-4-(1-ethoxyethylidene)-5-(trifluoromethyl)-2-pyrazolin-3-one Formula: C15H12F3N3O2S MolecularWeight: 355.33489

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12F3N3O2S/c1-3-23-8(2)11-12(15(16,17)18)20-21(13(11)22)14-19-9-6-4-5-7-10(9)24-14/h4-7H,3H2,1-2H3