5-tert-butyl-3-(3-chloranyl-2-fluoranyl-4-prop-2-ynoxy-phenyl)-1,3,4-thiadiazol-2-one

Systemtic Name: 5-tert-butyl-3-(3-chloranyl-2-fluoranyl-4-prop-2-ynoxy-phenyl)-1,3,4-thiadiazol-2-one Openeye Name: 5-tert-butyl-3-(3-chloro-2-fluoro-4-prop-2-ynoxy-phenyl)-1,3,4-thiadiazol-2-one CAS Name: 5-tert-butyl-3-(3-chloro-2-fluoro-4-prop-2-ynoxyphenyl)-1,3,4-thiadiazol-2-one IUPAC Name: 5-tert-butyl-3-(3-chloro-2-fluoro-4-prop-2-ynoxyphenyl)-1,3,4-thiadiazol-2-one Traditional Name: 5-tert-butyl-3-(3-chloro-2-fluoro-4-propargyloxy-phenyl)-1,3,4-thiadiazol-2-one Formula: C15H14ClFN2O2S MolecularWeight: 340.800263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=O)S1)C2=C(C(=C(C=C2)OCC#C)Cl)F

Isomeric SMILES

CC(C)(C)C1=NN(C(=O)S1)C2=C(C(=C(C=C2)OCC#C)Cl)F

InChI

InChI=1S/C15H14ClFN2O2S/c1-5-8-21-10-7-6-9(12(17)11(10)16)19-14(20)22-13(18-19)15(2,3)4/h1,6-7H,8H2,2-4H3