(2-phenyl-1,3-thiazol-4-yl)methyl 2-fluoranyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 2-fluoranyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: (2-phenylthiazol-4-yl)methyl 2-fluoro-5-morpholinosulfonyl-benzoate CAS Name: 2-fluoro-5-(4-morpholinylsulfonyl)benzoic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 2-fluoro-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-fluoro-5-morpholinosulfonyl-benzoic acid (2-phenylthiazol-4-yl)methyl ester Formula: C21H19FN2O5S2 MolecularWeight: 462.514363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)OCC3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)OCC3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H19FN2O5S2/c22-19-7-6-17(31(26,27)24-8-10-28-11-9-24)12-18(19)21(25)29-13-16-14-30-20(23-16)15-4-2-1-3-5-15/h1-7,12,14H,8-11,13H2