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

Systemtic Name: O-methyl N-[[(5S)-3-(3-fluoranyl-4-pyridin-4-yl-phenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]carbamothioate Openeye Name: O-methyl N-[[(5S)-3-[3-fluoro-4-(4-pyridyl)phenyl]-2-oxo-oxazolidin-5-yl]methyl]carbamothioate CAS Name: N-[[(5S)-3-(3-fluoro-4-pyridin-4-ylphenyl)-2-oxo-5-oxazolidinyl]methyl]carbamothioic acid O-methyl ester IUPAC Name: O-methyl N-[[(5S)-3-(3-fluoro-4-pyridin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]carbamothioate Traditional Name: N-[[(5S)-3-[3-fluoro-4-(4-pyridyl)phenyl]-2-keto-oxazolidin-5-yl]methyl]thiocarbamic acid O-methyl ester Formula: C17H16FN3O3S MolecularWeight: 361.390643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16FN3O3S/c1-23-16(25)20-9-13-10-21(17(22)24-13)12-2-3-14(15(18)8-12)11-4-6-19-7-5-11/h2-8,13H,9-10H2,1H3,(H,20,25)/t13-/m0/s1