5-tert-butyl-3-(6-fluoranyl-2-oxidanylidene-4-prop-2-ynyl-3H-1,3-benzothiazol-5-yl)-1,3,4-oxadiazol-2-one

Systemtic Name: 5-tert-butyl-3-(6-fluoranyl-2-oxidanylidene-4-prop-2-ynyl-3H-1,3-benzothiazol-5-yl)-1,3,4-oxadiazol-2-one Openeye Name: 5-tert-butyl-3-(6-fluoro-2-oxo-4-prop-2-ynyl-3H-1,3-benzothiazol-5-yl)-1,3,4-oxadiazol-2-one CAS Name: 5-tert-butyl-3-(6-fluoro-2-oxo-4-prop-2-ynyl-3H-1,3-benzothiazol-5-yl)-1,3,4-oxadiazol-2-one IUPAC Name: 5-tert-butyl-3-(6-fluoro-2-oxo-4-prop-2-ynyl-3H-1,3-benzothiazol-5-yl)-1,3,4-oxadiazol-2-one Traditional Name: 5-tert-butyl-3-(6-fluoro-2-keto-4-propargyl-3H-1,3-benzothiazol-5-yl)-1,3,4-oxadiazol-2-one Formula: C16H14FN3O3S MolecularWeight: 347.364063

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=O)O1)C2=C(C3=C(C=C2F)SC(=O)N3)CC#C

Isomeric SMILES

CC(C)(C)C1=NN(C(=O)O1)C2=C(C3=C(C=C2F)SC(=O)N3)CC#C

InChI

InChI=1S/C16H14FN3O3S/c1-5-6-8-11-10(24-14(21)18-11)7-9(17)12(8)20-15(22)23-13(19-20)16(2,3)4/h1,7H,6H2,2-4H3,(H,18,21)