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

Systemtic Name: N-[[3-(3-fluoranyl-4-thiomorpholin-4-yl-phenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]cyclohexanecarbothioamide Openeye Name: N-[[3-(3-fluoro-4-thiomorpholino-phenyl)-2-oxo-oxazolidin-5-yl]methyl]cyclohexanecarbothioamide CAS Name: N-[[3-(3-fluoro-4-thiomorpholin-4-ylphenyl)-2-oxo-5-oxazolidinyl]methyl]cyclohexanecarbothioamide IUPAC Name: N-[[3-(3-fluoro-4-thiomorpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]cyclohexanecarbothioamide Traditional Name: N-[[3-(3-fluoro-4-thiomorpholino-phenyl)-2-keto-oxazolidin-5-yl]methyl]cyclohexanecarbothioamide Formula: C21H28FN3O2S2 MolecularWeight: 437.594323

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=S)NCC2CN(C(=O)O2)C3=CC(=C(C=C3)N4CCSCC4)F

Isomeric SMILES

C1CCC(CC1)C(=S)NCC2CN(C(=O)O2)C3=CC(=C(C=C3)N4CCSCC4)F

InChI

InChI=1S/C21H28FN3O2S2/c22-18-12-16(6-7-19(18)24-8-10-29-11-9-24)25-14-17(27-21(25)26)13-23-20(28)15-4-2-1-3-5-15/h6-7,12,15,17H,1-5,8-11,13-14H2,(H,23,28)