[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-[furan-2-ylmethyl-(4-methylphenyl)sulfonyl-amino]ethanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-[furan-2-ylmethyl-(4-methylphenyl)sulfonyl-amino]ethanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-[2-furylmethyl(p-tolylsulfonyl)amino]acetate CAS Name: 2-[2-furanylmethyl-(4-methylphenyl)sulfonylamino]acetic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-[furan-2-ylmethyl-(4-methylphenyl)sulfonylamino]acetate Traditional Name: 2-[2-furfuryl(tosyl)amino]acetic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CO2)CC(=O)OCC(=O)NCC#C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CO2)CC(=O)OCC(=O)NCC#C

InChI

InChI=1S/C19H20N2O6S/c1-3-10-20-18(22)14-27-19(23)13-21(12-16-5-4-11-26-16)28(24,25)17-8-6-15(2)7-9-17/h1,4-9,11H,10,12-14H2,2H3,(H,20,22)