2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl 4-methyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: 2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl 4-methyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]amino]ethyl 4-methyl-3-morpholinosulfonyl-benzoate CAS Name: 4-methyl-3-(4-morpholinylsulfonyl)benzoic acid 2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl ester IUPAC Name: 2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl 4-methyl-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-methyl-3-morpholinosulfonyl-benzoic acid 2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]amino]ethyl ester Formula: C20H21ClF3N3O5S MolecularWeight: 507.91105

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCCNC2=C(C=C(C=N2)C(F)(F)F)Cl)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCCNC2=C(C=C(C=N2)C(F)(F)F)Cl)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H21ClF3N3O5S/c1-13-2-3-14(10-17(13)33(29,30)27-5-8-31-9-6-27)19(28)32-7-4-25-18-16(21)11-15(12-26-18)20(22,23)24/h2-3,10-12H,4-9H2,1H3,(H,25,26)