2-[[3-chloranyl-5-[[5-chloranyl-4-[4-fluoranyl-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]carbamoyl]pyridin-2-yl]amino]butanoic acid

Systemtic Name: 2-[[3-chloranyl-5-[[5-chloranyl-4-[4-fluoranyl-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]carbamoyl]pyridin-2-yl]amino]butanoic acid Openeye Name: 2-[[3-chloro-5-[[5-chloro-4-[4-fluoro-3-(trifluoromethyl)phenyl]thiazol-2-yl]carbamoyl]-2-pyridyl]amino]butanoic acid CAS Name: 2-[[3-chloro-5-[[[5-chloro-4-[4-fluoro-3-(trifluoromethyl)phenyl]-2-thiazolyl]amino]-oxomethyl]-2-pyridinyl]amino]butanoic acid IUPAC Name: 2-[[3-chloro-5-[[5-chloro-4-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]carbamoyl]pyridin-2-yl]amino]butanoic acid Traditional Name: 2-[[3-chloro-5-[[5-chloro-4-[4-fluoro-3-(trifluoromethyl)phenyl]thiazol-2-yl]carbamoyl]-2-pyridyl]amino]butyric acid Formula: C20H14Cl2F4N4O3S MolecularWeight: 537.314773

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC1=C(C=C(C=N1)C(=O)NC2=NC(=C(S2)Cl)C3=CC(=C(C=C3)F)C(F)(F)F)Cl

Isomeric SMILES

CCC(C(=O)O)NC1=C(C=C(C=N1)C(=O)NC2=NC(=C(S2)Cl)C3=CC(=C(C=C3)F)C(F)(F)F)Cl

InChI

InChI=1S/C20H14Cl2F4N4O3S/c1-2-13(18(32)33)28-16-11(21)6-9(7-27-16)17(31)30-19-29-14(15(22)34-19)8-3-4-12(23)10(5-8)20(24,25)26/h3-7,13H,2H2,1H3,(H,27,28)(H,32,33)(H,29,30,31)