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

Systemtic Name: 5-tert-butyl-3-(5-but-2-ynoxy-4-chloranyl-2-fluoranyl-phenyl)-1,3,4-thiadiazol-2-one Openeye Name: 5-tert-butyl-3-(5-but-2-ynoxy-4-chloro-2-fluoro-phenyl)-1,3,4-thiadiazol-2-one CAS Name: 5-tert-butyl-3-(5-but-2-ynoxy-4-chloro-2-fluorophenyl)-1,3,4-thiadiazol-2-one IUPAC Name: 5-tert-butyl-3-(5-but-2-ynoxy-4-chloro-2-fluorophenyl)-1,3,4-thiadiazol-2-one Traditional Name: 5-tert-butyl-3-(5-but-2-ynoxy-4-chloro-2-fluoro-phenyl)-1,3,4-thiadiazol-2-one Formula: C16H16ClFN2O2S MolecularWeight: 354.826843

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=C(C=C(C(=C1)N2C(=O)SC(=N2)C(C)(C)C)F)Cl

Isomeric SMILES

CC#CCOC1=C(C=C(C(=C1)N2C(=O)SC(=N2)C(C)(C)C)F)Cl

InChI

InChI=1S/C16H16ClFN2O2S/c1-5-6-7-22-13-9-12(11(18)8-10(13)17)20-15(21)23-14(19-20)16(2,3)4/h8-9H,7H2,1-4H3