tert-butyl 3-[[2,4-bis(fluoranyl)phenyl]sulfanylmethyl]azetidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[2,4-bis(fluoranyl)phenyl]sulfanylmethyl]azetidine-1-carboxylate Openeye Name: tert-butyl 3-[(2,4-difluorophenyl)sulfanylmethyl]azetidine-1-carboxylate CAS Name: 3-[[(2,4-difluorophenyl)thio]methyl]-1-azetidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(2,4-difluorophenyl)sulfanylmethyl]azetidine-1-carboxylate Traditional Name: 3-[[(2,4-difluorophenyl)thio]methyl]azetidine-1-carboxylic acid tert-butyl ester Formula: C15H19F2NO2S MolecularWeight: 315.378666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(C1)CSC2=C(C=C(C=C2)F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(C1)CSC2=C(C=C(C=C2)F)F

InChI

InChI=1S/C15H19F2NO2S/c1-15(2,3)20-14(19)18-7-10(8-18)9-21-13-5-4-11(16)6-12(13)17/h4-6,10H,7-9H2,1-3H3