O-propan-2-yl N-[[(5S)-3-[(3aS)-9-fluoranyl-2,3,3a,4-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzoxazin-7-yl]-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]carbamothioate

Systemtic Name: O-propan-2-yl N-[[(5S)-3-[(3aS)-9-fluoranyl-2,3,3a,4-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzoxazin-7-yl]-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]carbamothioate Openeye Name: O-isopropyl N-[[(5S)-3-[(3aS)-9-fluoro-2,3,3a,4-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzoxazin-7-yl]-2-oxo-oxazolidin-5-yl]methyl]carbamothioate CAS Name: N-[[(5S)-3-[(3aS)-9-fluoro-2,3,3a,4-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzoxazin-7-yl]-2-oxo-5-oxazolidinyl]methyl]carbamothioic acid O-propan-2-yl ester IUPAC Name: O-propan-2-yl N-[[(5S)-3-[(3aS)-9-fluoro-2,3,3a,4-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzoxazin-7-yl]-2-oxo-1,3-oxazolidin-5-yl]methyl]carbamothioate Traditional Name: N-[[(5S)-3-[(3aS)-9-fluoro-2,3,3a,4-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzoxazin-7-yl]-2-keto-oxazolidin-5-yl]methyl]thiocarbamic acid O-isopropyl ester Formula: C19H24FN3O4S MolecularWeight: 409.474963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=S)NCC1CN(C(=O)O1)C2=CC3=C(C(=C2)F)N4CCCC4CO3

Isomeric SMILES

CC(C)OC(=S)NC[C@H]1CN(C(=O)O1)C2=CC3=C(C(=C2)F)N4CCC[C@H]4CO3

InChI

InChI=1S/C19H24FN3O4S/c1-11(2)26-18(28)21-8-14-9-23(19(24)27-14)13-6-15(20)17-16(7-13)25-10-12-4-3-5-22(12)17/h6-7,11-12,14H,3-5,8-10H2,1-2H3,(H,21,28)/t12-,14-/m0/s1