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

Systemtic Name: N-[[3-[3,5-bis(fluoranyl)-4-(4-methanoylpiperazin-1-yl)phenyl]-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]ethanethioamide Openeye Name: N-[[3-[3,5-difluoro-4-(4-formylpiperazin-1-yl)phenyl]-2-oxo-oxazolidin-5-yl]methyl]thioacetamide CAS Name: N-[[3-[3,5-difluoro-4-(4-formyl-1-piperazinyl)phenyl]-2-oxo-5-oxazolidinyl]methyl]ethanethioamide IUPAC Name: N-[[3-[3,5-difluoro-4-(4-formylpiperazin-1-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]ethanethioamide Traditional Name: N-[[3-[3,5-difluoro-4-(4-formylpiperazino)phenyl]-2-keto-oxazolidin-5-yl]methyl]thioacetamide Formula: C17H20F2N4O3S MolecularWeight: 398.427506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20F2N4O3S/c1-11(27)20-8-13-9-23(17(25)26-13)12-6-14(18)16(15(19)7-12)22-4-2-21(10-24)3-5-22/h6-7,10,13H,2-5,8-9H2,1H3,(H,20,27)