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

Systemtic Name: O-methyl N-[[(5S)-3-(3-fluoranyl-4-pyrrol-1-yl-phenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]carbamothioate Openeye Name: O-methyl N-[[(5S)-3-(3-fluoro-4-pyrrol-1-yl-phenyl)-2-oxo-oxazolidin-5-yl]methyl]carbamothioate CAS Name: N-[[(5S)-3-[3-fluoro-4-(1-pyrrolyl)phenyl]-2-oxo-5-oxazolidinyl]methyl]carbamothioic acid O-methyl ester IUPAC Name: O-methyl N-[[(5S)-3-(3-fluoro-4-pyrrol-1-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]carbamothioate Traditional Name: N-[[(5S)-3-(3-fluoro-4-pyrrol-1-yl-phenyl)-2-keto-oxazolidin-5-yl]methyl]thiocarbamic acid O-methyl ester Formula: C16H16FN3O3S MolecularWeight: 349.379943

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Descriptors Computed from Structure

Canonical SMILES:

COC(=S)NCC1CN(C(=O)O1)C2=CC(=C(C=C2)N3C=CC=C3)F

Isomeric SMILES

COC(=S)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)N3C=CC=C3)F

InChI

InChI=1S/C16H16FN3O3S/c1-22-15(24)18-9-12-10-20(16(21)23-12)11-4-5-14(13(17)8-11)19-6-2-3-7-19/h2-8,12H,9-10H2,1H3,(H,18,24)/t12-/m0/s1