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

Systemtic Name: 2-cyclobutyl-N-[[3-[4-(4-ethanoylpiperazin-1-yl)-3-fluoranyl-phenyl]-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]ethanethioamide Openeye Name: N-[[3-[4-(4-acetylpiperazin-1-yl)-3-fluoro-phenyl]-2-oxo-oxazolidin-5-yl]methyl]-2-cyclobutyl-thioacetamide CAS Name: N-[[3-[4-(4-acetyl-1-piperazinyl)-3-fluorophenyl]-2-oxo-5-oxazolidinyl]methyl]-2-cyclobutylethanethioamide IUPAC Name: N-[[3-[4-(4-acetylpiperazin-1-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]-2-cyclobutylethanethioamide Traditional Name: N-[[3-[4-(4-acetylpiperazino)-3-fluoro-phenyl]-2-keto-oxazolidin-5-yl]methyl]-2-cyclobutyl-thioacetamide Formula: C22H29FN4O3S MolecularWeight: 448.554063

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)N3CC(OC3=O)CNC(=S)CC4CCC4)F

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)N3CC(OC3=O)CNC(=S)CC4CCC4)F

InChI

InChI=1S/C22H29FN4O3S/c1-15(28)25-7-9-26(10-8-25)20-6-5-17(12-19(20)23)27-14-18(30-22(27)29)13-24-21(31)11-16-3-2-4-16/h5-6,12,16,18H,2-4,7-11,13-14H2,1H3,(H,24,31)