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

Systemtic Name: O-methyl N-[[(5S)-3-(3-fluoranyl-4-pyrazol-1-yl-phenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]carbamothioate Openeye Name: O-methyl N-[[(5S)-3-(3-fluoro-4-pyrazol-1-yl-phenyl)-2-oxo-oxazolidin-5-yl]methyl]carbamothioate CAS Name: N-[[(5S)-3-[3-fluoro-4-(1-pyrazolyl)phenyl]-2-oxo-5-oxazolidinyl]methyl]carbamothioic acid O-methyl ester IUPAC Name: O-methyl N-[[(5S)-3-(3-fluoro-4-pyrazol-1-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]carbamothioate Traditional Name: N-[[(5S)-3-(3-fluoro-4-pyrazol-1-yl-phenyl)-2-keto-oxazolidin-5-yl]methyl]thiocarbamic acid O-methyl ester Formula: C15H15FN4O3S MolecularWeight: 350.368003

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Descriptors Computed from Structure

Canonical SMILES:

COC(=S)NCC1CN(C(=O)O1)C2=CC(=C(C=C2)N3C=CC=N3)F

Isomeric SMILES

COC(=S)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)N3C=CC=N3)F

InChI

InChI=1S/C15H15FN4O3S/c1-22-14(24)17-8-11-9-19(15(21)23-11)10-3-4-13(12(16)7-10)20-6-2-5-18-20/h2-7,11H,8-9H2,1H3,(H,17,24)/t11-/m0/s1