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Methyl 2-(N-Phenylsulfonyl-N-propargylamino)-3-(1-phenylsulfonylimidazol-4-yl)propionate
SpectraBase Compound ID 9nrePl6UFj
InChI InChI=1S/C22H21N3O6S2/c1-3-14-25(33(29,30)20-12-8-5-9-13-20)21(22(26)31-2)15-18-16-24(17-23-18)32(27,28)19-10-6-4-7-11-19/h1,4-13,16-17,21H,14-15H2,2H3
InChIKey ZXGQOVYKALXDTA-UHFFFAOYSA-N
Mol Weight 487.55 g/mol
Molecular Formula C22H21N3O6S2
Exact Mass 487.087178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LXrGYbH6veS
Name Methyl 2-(N-Phenylsulfonyl-N-propargylamino)-3-(1-phenylsulfonylimidazol-4-yl)propionate
Alternate Name(s) Methyl 3-[1-(phenylsulfonyl)-1H-imidazol-4-yl]-2-[(phenylsulfonyl)(2-propynyl)amino]propanoate 3-[1-(benzenesulfonyl)-4-imidazolyl]-2-[benzenesulfonyl(prop-2-ynyl)amino]propanoic acid methyl ester Methyl 3-[1-(benzenesulfonyl)imidazol-4-yl]-2-[benzenesulfonyl(prop-2-ynyl)amino]propanoate Methyl 3-[1-(phenylsulfonyl)imidazol-4-yl]-2-[phenylsulfonyl(prop-2-ynyl)amino]propanoate
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Formula C22H21N3O6S2
InChI InChI=1S/C22H21N3O6S2/c1-3-14-25(33(29,30)20-12-8-5-9-13-20)21(22(26)31-2)15-18-16-24(17-23-18)32(27,28)19-10-6-4-7-11-19/h1,4-13,16-17,21H,14-15H2,2H3
InChIKey ZXGQOVYKALXDTA-UHFFFAOYSA-N
Molecular Weight 487.545 g/mol
SMILES c1(S([n]2cc(CC(N(S(=O)(=O)c3ccccc3)CC#C)C(=O)OC)nc2)(=O)=O)ccccc1
SPLASH splash10-004l-9402000000-b395f0afd9f5216b2a3e
Source of Spectrum F-57-611-2
Wiley ID 1549329