S-[2-[4-[2,3-dihydro-1-benzofuran-5-ylsulfonyl(methyl)amino]phenyl]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[4-[2,3-dihydro-1-benzofuran-5-ylsulfonyl(methyl)amino]phenyl]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[4-[2,3-dihydrobenzofuran-5-ylsulfonyl(methyl)amino]phenyl]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[4-[2,3-dihydrobenzofuran-5-ylsulfonyl(methyl)amino]phenyl]-2-oxoethyl] ester IUPAC Name: S-[2-[4-[2,3-dihydro-1-benzofuran-5-ylsulfonyl(methyl)amino]phenyl]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[4-[coumaran-5-ylsulfonyl(methyl)amino]phenyl]-2-keto-ethyl] ester Formula: C19H19NO5S2 MolecularWeight: 405.48786

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)C1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC3=C(C=C2)OCC3

Isomeric SMILES

CC(=O)SCC(=O)C1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC3=C(C=C2)OCC3

InChI

InChI=1S/C19H19NO5S2/c1-13(21)26-12-18(22)14-3-5-16(6-4-14)20(2)27(23,24)17-7-8-19-15(11-17)9-10-25-19/h3-8,11H,9-10,12H2,1-2H3