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

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 4-fluoranyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl 4-fluoro-3-morpholinosulfonyl-benzoate CAS Name: 4-fluoro-3-(4-morpholinylsulfonyl)benzoic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 4-fluoro-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-fluoro-3-morpholinosulfonyl-benzoic acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C19H17FN2O5S3 MolecularWeight: 468.542083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17FN2O5S3/c20-16-2-1-13(9-17(16)30(24,25)22-4-6-26-7-5-22)19(23)27-10-15-12-29-18(21-15)14-3-8-28-11-14/h1-3,8-9,11-12H,4-7,10H2