[2-fluoranyl-4-(2-methyl-1,3-thiazol-4-yl)phenyl] 3,4-dimethoxybenzenesulfonate

Systemtic Name: [2-fluoranyl-4-(2-methyl-1,3-thiazol-4-yl)phenyl] 3,4-dimethoxybenzenesulfonate Openeye Name: [2-fluoro-4-(2-methylthiazol-4-yl)phenyl] 3,4-dimethoxybenzenesulfonate CAS Name: 3,4-dimethoxybenzenesulfonic acid [2-fluoro-4-(2-methyl-4-thiazolyl)phenyl] ester IUPAC Name: [2-fluoro-4-(2-methyl-1,3-thiazol-4-yl)phenyl] 3,4-dimethoxybenzenesulfonate Traditional Name: 3,4-dimethoxybenzenesulfonic acid [2-fluoro-4-(2-methylthiazol-4-yl)phenyl] ester Formula: C18H16FNO5S2 MolecularWeight: 409.451743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC(=C(C=C2)OS(=O)(=O)C3=CC(=C(C=C3)OC)OC)F

Isomeric SMILES

CC1=NC(=CS1)C2=CC(=C(C=C2)OS(=O)(=O)C3=CC(=C(C=C3)OC)OC)F

InChI

InChI=1S/C18H16FNO5S2/c1-11-20-15(10-26-11)12-4-6-16(14(19)8-12)25-27(21,22)13-5-7-17(23-2)18(9-13)24-3/h4-10H,1-3H3