trifluoromethyl 2-[[5-(4-fluoranyl-3-methylsulfonyl-phenyl)-4-methyl-1,3-thiazol-2-yl]carbamoylamino]ethanoate

Systemtic Name: trifluoromethyl 2-[[5-(4-fluoranyl-3-methylsulfonyl-phenyl)-4-methyl-1,3-thiazol-2-yl]carbamoylamino]ethanoate Openeye Name: trifluoromethyl 2-[[5-(4-fluoro-3-methylsulfonyl-phenyl)-4-methyl-thiazol-2-yl]carbamoylamino]acetate CAS Name: 2-[[[[5-(4-fluoro-3-methylsulfonylphenyl)-4-methyl-2-thiazolyl]amino]-oxomethyl]amino]acetic acid trifluoromethyl ester IUPAC Name: trifluoromethyl 2-[[5-(4-fluoro-3-methylsulfonylphenyl)-4-methyl-1,3-thiazol-2-yl]carbamoylamino]acetate Traditional Name: 2-[[5-(4-fluoro-3-mesyl-phenyl)-4-methyl-thiazol-2-yl]carbamoylamino]acetic acid trifluoromethyl ester Formula: C15H13F4N3O5S2 MolecularWeight: 455.404433

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)NCC(=O)OC(F)(F)F)C2=CC(=C(C=C2)F)S(=O)(=O)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)NCC(=O)OC(F)(F)F)C2=CC(=C(C=C2)F)S(=O)(=O)C

InChI

InChI=1S/C15H13F4N3O5S2/c1-7-12(8-3-4-9(16)10(5-8)29(2,25)26)28-14(21-7)22-13(24)20-6-11(23)27-15(17,18)19/h3-5H,6H2,1-2H3,(H2,20,21,22,24)