N-[[3-[3-fluoranyl-4-[4-(2-methoxyethanoyl)piperazin-1-yl]phenyl]-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]butanethioamide

Systemtic Name: N-[[3-[3-fluoranyl-4-[4-(2-methoxyethanoyl)piperazin-1-yl]phenyl]-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]butanethioamide Openeye Name: N-[[3-[3-fluoro-4-[4-(2-methoxyacetyl)piperazin-1-yl]phenyl]-2-oxo-oxazolidin-5-yl]methyl]butanethioamide CAS Name: N-[[3-[3-fluoro-4-[4-(2-methoxy-1-oxoethyl)-1-piperazinyl]phenyl]-2-oxo-5-oxazolidinyl]methyl]butanethioamide IUPAC Name: N-[[3-[3-fluoro-4-[4-(2-methoxyacetyl)piperazin-1-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]butanethioamide Traditional Name: N-[[3-[3-fluoro-4-[4-(2-methoxyacetyl)piperazino]phenyl]-2-keto-oxazolidin-5-yl]methyl]thiobutyramide Formula: C21H29FN4O4S MolecularWeight: 452.542763

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29FN4O4S/c1-3-4-19(31)23-12-16-13-26(21(28)30-16)15-5-6-18(17(22)11-15)24-7-9-25(10-8-24)20(27)14-29-2/h5-6,11,16H,3-4,7-10,12-14H2,1-2H3,(H,23,31)