N-[3-[3-fluoranyl-4-(1-oxidanylidenethian-4-yl)phenyl]-2-oxidanylidene-1,3-oxazolidin-5-yl]-N-methyl-propanamide hydrate

Systemtic Name: N-[3-[3-fluoranyl-4-(1-oxidanylidenethian-4-yl)phenyl]-2-oxidanylidene-1,3-oxazolidin-5-yl]-N-methyl-propanamide hydrate Openeye Name: N-[3-[3-fluoro-4-(1-oxothian-4-yl)phenyl]-2-oxo-oxazolidin-5-yl]-N-methyl-propanamide hydrate CAS Name: N-[3-[3-fluoro-4-(1-oxo-4-thianyl)phenyl]-2-oxo-5-oxazolidinyl]-N-methylpropanamide hydrate IUPAC Name: N-[3-[3-fluoro-4-(1-oxothian-4-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]-N-methylpropanamide hydrate Traditional Name: N-[3-[3-fluoro-4-(1-ketothian-4-yl)phenyl]-2-keto-oxazolidin-5-yl]-N-methyl-propionamide hydrate Formula: C18H25FN2O5S MolecularWeight: 400.464903

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C)C1CN(C(=O)O1)C2=CC(=C(C=C2)C3CCS(=O)CC3)F.O

Isomeric SMILES

CCC(=O)N(C)C1CN(C(=O)O1)C2=CC(=C(C=C2)C3CCS(=O)CC3)F.O

InChI

InChI=1S/C18H23FN2O4S.H2O/c1-3-16(22)20(2)17-11-21(18(23)25-17)13-4-5-14(15(19)10-13)12-6-8-26(24)9-7-12;/h4-5,10,12,17H,3,6-9,11H2,1-2H3;1H2