1-[1,3-thiazol-2-yl-[8-(trifluoromethyl)quinolin-3-yl]carbonyl-amino]propyl propanoate

Systemtic Name: 1-[1,3-thiazol-2-yl-[8-(trifluoromethyl)quinolin-3-yl]carbonyl-amino]propyl propanoate Openeye Name: 1-[thiazol-2-yl-[8-(trifluoromethyl)quinoline-3-carbonyl]amino]propyl propanoate CAS Name: propanoic acid 1-[[oxo-[8-(trifluoromethyl)-3-quinolinyl]methyl]-(2-thiazolyl)amino]propyl ester IUPAC Name: 1-[1,3-thiazol-2-yl-[8-(trifluoromethyl)quinoline-3-carbonyl]amino]propyl propanoate Traditional Name: propionic acid 1-[thiazol-2-yl-[8-(trifluoromethyl)quinoline-3-carbonyl]amino]propyl ester Formula: C20H18F3N3O3S MolecularWeight: 437.43543

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N(C1=NC=CS1)C(=O)C2=CN=C3C(=C2)C=CC=C3C(F)(F)F)OC(=O)CC

Isomeric SMILES

CCC(N(C1=NC=CS1)C(=O)C2=CN=C3C(=C2)C=CC=C3C(F)(F)F)OC(=O)CC

InChI

InChI=1S/C20H18F3N3O3S/c1-3-15(29-16(27)4-2)26(19-24-8-9-30-19)18(28)13-10-12-6-5-7-14(20(21,22)23)17(12)25-11-13/h5-11,15H,3-4H2,1-2H3