methyl 3,3,3-tris(fluoranyl)-2-(furan-2-ylcarbonylamino)-2-[[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]amino]propanoate

Systemtic Name: methyl 3,3,3-tris(fluoranyl)-2-(furan-2-ylcarbonylamino)-2-[[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]amino]propanoate Openeye Name: methyl 3,3,3-trifluoro-2-(furan-2-carbonylamino)-2-[[5-(4-nitrophenyl)sulfonylthiazol-2-yl]amino]propanoate CAS Name: 3,3,3-trifluoro-2-[[2-furanyl(oxo)methyl]amino]-2-[[5-(4-nitrophenyl)sulfonyl-2-thiazolyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3,3,3-trifluoro-2-(furan-2-carbonylamino)-2-[[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]amino]propanoate Traditional Name: 3,3,3-trifluoro-2-(2-furoylamino)-2-[(5-nosylthiazol-2-yl)amino]propionic acid methyl ester Formula: C18H13F3N4O8S2 MolecularWeight: 534.44303

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(F)(F)F)(NC1=NC=C(S1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC=CO3

Isomeric SMILES

COC(=O)C(C(F)(F)F)(NC1=NC=C(S1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC=CO3

InChI

InChI=1S/C18H13F3N4O8S2/c1-32-15(27)17(18(19,20)21,23-14(26)12-3-2-8-33-12)24-16-22-9-13(34-16)35(30,31)11-6-4-10(5-7-11)25(28)29/h2-9H,1H3,(H,22,24)(H,23,26)