4-[5-[(ethanethioylamino)methyl]-2-oxidanylidene-1,3-oxazolidin-3-yl]-2-fluoranyl-4-(2H-thiopyran-4-yl)cyclohexan-1-olate

Systemtic Name: 4-[5-[(ethanethioylamino)methyl]-2-oxidanylidene-1,3-oxazolidin-3-yl]-2-fluoranyl-4-(2H-thiopyran-4-yl)cyclohexan-1-olate Openeye Name: 4-[5-[(ethanethioylamino)methyl]-2-oxo-oxazolidin-3-yl]-2-fluoro-4-(2H-thiopyran-4-yl)cyclohexanolate CAS Name: 2-fluoro-4-[2-oxo-5-[(1-sulfanylideneethylamino)methyl]-3-oxazolidinyl]-4-(2H-thiopyran-4-yl)-1-cyclohexanolate IUPAC Name: 4-[5-[(ethanethioylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-4-(2H-thiopyran-4-yl)cyclohexan-1-olate Traditional Name: 2-fluoro-4-[2-keto-5-[(thioacetylamino)methyl]oxazolidin-3-yl]-4-(2H-thiopyran-4-yl)cyclohexanolate Formula: C17H22FN2O3S2- MolecularWeight: 385.496583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=S)NCC1CN(C(=O)O1)C2(CCC(C(C2)F)[O-])C3=CCSC=C3

Isomeric SMILES

CC(=S)NCC1CN(C(=O)O1)C2(CCC(C(C2)F)[O-])C3=CCSC=C3

InChI

InChI=1S/C17H22FN2O3S2/c1-11(24)19-9-13-10-20(16(22)23-13)17(12-3-6-25-7-4-12)5-2-15(21)14(18)8-17/h3-4,6,13-15H,2,5,7-10H2,1H3,(H,19,24)/q-1