O-methyl N-[3-[3-fluoranyl-4-(4-pyridin-4-ylcarbonylpiperazin-1-yl)phenyl]-2-oxidanylidene-1,3-oxazolidin-5-yl]-N-methyl-carbamothioate

Systemtic Name: O-methyl N-[3-[3-fluoranyl-4-(4-pyridin-4-ylcarbonylpiperazin-1-yl)phenyl]-2-oxidanylidene-1,3-oxazolidin-5-yl]-N-methyl-carbamothioate Openeye Name: O-methyl N-[3-[3-fluoro-4-[4-(pyridine-4-carbonyl)piperazin-1-yl]phenyl]-2-oxo-oxazolidin-5-yl]-N-methyl-carbamothioate CAS Name: N-[3-[3-fluoro-4-[4-[oxo(pyridin-4-yl)methyl]-1-piperazinyl]phenyl]-2-oxo-5-oxazolidinyl]-N-methylcarbamothioic acid O-methyl ester IUPAC Name: O-methyl N-[3-[3-fluoro-4-[4-(pyridine-4-carbonyl)piperazin-1-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]-N-methylcarbamothioate Traditional Name: N-[3-[3-fluoro-4-(4-isonicotinoylpiperazino)phenyl]-2-keto-oxazolidin-5-yl]-N-methyl-thiocarbamic acid O-methyl ester Formula: C22H24FN5O4S MolecularWeight: 473.520463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CN(C(=O)O1)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=NC=C4)F)C(=S)OC

Isomeric SMILES

CN(C1CN(C(=O)O1)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=NC=C4)F)C(=S)OC

InChI

InChI=1S/C22H24FN5O4S/c1-25(22(33)31-2)19-14-28(21(30)32-19)16-3-4-18(17(23)13-16)26-9-11-27(12-10-26)20(29)15-5-7-24-8-6-15/h3-8,13,19H,9-12,14H2,1-2H3