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

Systemtic Name: N-[[3-[3-fluoranyl-4-(4-methylsulfonylpiperazin-1-yl)phenyl]-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]propanethioamide Openeye Name: N-[[3-[3-fluoro-4-(4-methylsulfonylpiperazin-1-yl)phenyl]-2-oxo-oxazolidin-5-yl]methyl]propanethioamide CAS Name: N-[[3-[3-fluoro-4-(4-methylsulfonyl-1-piperazinyl)phenyl]-2-oxo-5-oxazolidinyl]methyl]propanethioamide IUPAC Name: N-[[3-[3-fluoro-4-(4-methylsulfonylpiperazin-1-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]propanethioamide Traditional Name: N-[[3-[3-fluoro-4-(4-mesylpiperazino)phenyl]-2-keto-oxazolidin-5-yl]methyl]thiopropionamide Formula: C18H25FN4O4S2 MolecularWeight: 444.543903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25FN4O4S2/c1-3-17(28)20-11-14-12-23(18(24)27-14)13-4-5-16(15(19)10-13)21-6-8-22(9-7-21)29(2,25)26/h4-5,10,14H,3,6-9,11-12H2,1-2H3,(H,20,28)