[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 4-chloranyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 4-chloranyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: [2-(4-fluorophenyl)thiazol-4-yl]methyl 4-chloro-3-morpholinosulfonyl-benzoate CAS Name: 4-chloro-3-(4-morpholinylsulfonyl)benzoic acid [2-(4-fluorophenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 4-chloro-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-chloro-3-morpholinosulfonyl-benzoic acid [2-(4-fluorophenyl)thiazol-4-yl]methyl ester Formula: C21H18ClFN2O5S2 MolecularWeight: 496.959423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClFN2O5S2/c22-18-6-3-15(11-19(18)32(27,28)25-7-9-29-10-8-25)21(26)30-12-17-13-31-20(24-17)14-1-4-16(23)5-2-14/h1-6,11,13H,7-10,12H2