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

Systemtic Name: N-[[3-[3,5-bis(fluoranyl)-4-(4-methylsulfonylpiperazin-1-yl)phenyl]-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]ethanethioamide Openeye Name: N-[[3-[3,5-difluoro-4-(4-methylsulfonylpiperazin-1-yl)phenyl]-2-oxo-oxazolidin-5-yl]methyl]thioacetamide CAS Name: N-[[3-[3,5-difluoro-4-(4-methylsulfonyl-1-piperazinyl)phenyl]-2-oxo-5-oxazolidinyl]methyl]ethanethioamide IUPAC Name: N-[[3-[3,5-difluoro-4-(4-methylsulfonylpiperazin-1-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]ethanethioamide Traditional Name: N-[[3-[3,5-difluoro-4-(4-mesylpiperazino)phenyl]-2-keto-oxazolidin-5-yl]methyl]thioacetamide Formula: C17H22F2N4O4S2 MolecularWeight: 448.507786

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)NCC1CN(C(=O)O1)C2=CC(=C(C(=C2)F)N3CCN(CC3)S(=O)(=O)C)F

Isomeric SMILES

CC(=S)NCC1CN(C(=O)O1)C2=CC(=C(C(=C2)F)N3CCN(CC3)S(=O)(=O)C)F

InChI

InChI=1S/C17H22F2N4O4S2/c1-11(28)20-9-13-10-23(17(24)27-13)12-7-14(18)16(15(19)8-12)21-3-5-22(6-4-21)29(2,25)26/h7-8,13H,3-6,9-10H2,1-2H3,(H,20,28)