tert-butyl N-[4-(4-fluorophenyl)-1-(furan-2-ylmethylsulfanyl)-2-oxidanylidene-butyl]carbamate

Systemtic Name: tert-butyl N-[4-(4-fluorophenyl)-1-(furan-2-ylmethylsulfanyl)-2-oxidanylidene-butyl]carbamate Openeye Name: tert-butyl N-[4-(4-fluorophenyl)-1-(2-furylmethylsulfanyl)-2-oxo-butyl]carbamate CAS Name: N-[4-(4-fluorophenyl)-1-(2-furanylmethylthio)-2-oxobutyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(4-fluorophenyl)-1-(furan-2-ylmethylsulfanyl)-2-oxobutyl]carbamate Traditional Name: N-[4-(4-fluorophenyl)-1-(2-furfurylthio)-2-keto-butyl]carbamic acid tert-butyl ester Formula: C20H24FNO4S MolecularWeight: 393.472263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C(=O)CCC1=CC=C(C=C1)F)SCC2=CC=CO2

Isomeric SMILES

CC(C)(C)OC(=O)NC(C(=O)CCC1=CC=C(C=C1)F)SCC2=CC=CO2

InChI

InChI=1S/C20H24FNO4S/c1-20(2,3)26-19(24)22-18(27-13-16-5-4-12-25-16)17(23)11-8-14-6-9-15(21)10-7-14/h4-7,9-10,12,18H,8,11,13H2,1-3H3,(H,22,24)