N-[[3-[4-(4-azido-3-iodanyl-phenyl)-3-fluoranyl-phenyl]-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]ethanethioamide

Systemtic Name: N-[[3-[4-(4-azido-3-iodanyl-phenyl)-3-fluoranyl-phenyl]-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]ethanethioamide Openeye Name: N-[[3-[4-(4-azido-3-iodo-phenyl)-3-fluoro-phenyl]-2-oxo-oxazolidin-5-yl]methyl]thioacetamide CAS Name: N-[[3-[4-(4-azido-3-iodophenyl)-3-fluorophenyl]-2-oxo-5-oxazolidinyl]methyl]ethanethioamide IUPAC Name: N-[[3-[4-(4-azido-3-iodophenyl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]ethanethioamide Traditional Name: N-[[3-[4-(4-azido-3-iodo-phenyl)-3-fluoro-phenyl]-2-keto-oxazolidin-5-yl]methyl]thioacetamide Formula: C18H15FIN5O2S MolecularWeight: 511.311873

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)NCC1CN(C(=O)O1)C2=CC(=C(C=C2)C3=CC(=C(C=C3)N=[N+]=[N-])I)F

Isomeric SMILES

CC(=S)NCC1CN(C(=O)O1)C2=CC(=C(C=C2)C3=CC(=C(C=C3)N=[N+]=[N-])I)F

InChI

InChI=1S/C18H15FIN5O2S/c1-10(28)22-8-13-9-25(18(26)27-13)12-3-4-14(15(19)7-12)11-2-5-17(23-24-21)16(20)6-11/h2-7,13H,8-9H2,1H3,(H,22,28)