(2,2-dimethyl-3H-1-benzofuran-7-yl) 2-[[(2-ethoxy-2-oxidanylidene-ethyl)-(4-methylphenyl)sulfonyl-amino]sulfanylamino]ethanoate

Systemtic Name: (2,2-dimethyl-3H-1-benzofuran-7-yl) 2-[[(2-ethoxy-2-oxidanylidene-ethyl)-(4-methylphenyl)sulfonyl-amino]sulfanylamino]ethanoate Openeye Name: (2,2-dimethyl-3H-benzofuran-7-yl) 2-[[(2-ethoxy-2-oxo-ethyl)-(p-tolylsulfonyl)amino]sulfanylamino]acetate CAS Name: 2-[[[(2-ethoxy-2-oxoethyl)-(4-methylphenyl)sulfonylamino]thio]amino]acetic acid (2,2-dimethyl-3H-benzofuran-7-yl) ester IUPAC Name: (2,2-dimethyl-3H-1-benzofuran-7-yl) 2-[[(2-ethoxy-2-oxoethyl)-(4-methylphenyl)sulfonylamino]sulfanylamino]acetate Traditional Name: 2-[[[(2-ethoxy-2-keto-ethyl)-tosyl-amino]thio]amino]acetic acid (2,2-dimethylcoumaran-7-yl) ester Formula: C23H28N2O7S2 MolecularWeight: 508.60762

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(SNCC(=O)OC1=CC=CC2=C1OC(C2)(C)C)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)CN(SNCC(=O)OC1=CC=CC2=C1OC(C2)(C)C)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H28N2O7S2/c1-5-30-21(27)15-25(34(28,29)18-11-9-16(2)10-12-18)33-24-14-20(26)31-19-8-6-7-17-13-23(3,4)32-22(17)19/h6-12,24H,5,13-15H2,1-4H3