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

Systemtic Name: [2-(2-methylpropylamino)-2-oxidanylidene-ethyl] 2-[furan-2-ylmethyl-(4-methylphenyl)sulfonyl-amino]ethanoate Openeye Name: [2-(isobutylamino)-2-oxo-ethyl] 2-[2-furylmethyl(p-tolylsulfonyl)amino]acetate CAS Name: 2-[2-furanylmethyl-(4-methylphenyl)sulfonylamino]acetic acid [2-(2-methylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylamino)-2-oxoethyl] 2-[furan-2-ylmethyl-(4-methylphenyl)sulfonylamino]acetate Traditional Name: 2-[2-furfuryl(tosyl)amino]acetic acid [2-(isobutylamino)-2-keto-ethyl] ester Formula: C20H26N2O6S MolecularWeight: 422.49524

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O6S/c1-15(2)11-21-19(23)14-28-20(24)13-22(12-17-5-4-10-27-17)29(25,26)18-8-6-16(3)7-9-18/h4-10,15H,11-14H2,1-3H3,(H,21,23)