S-[2-[4-[2-hydroxyethyl(1H-indol-3-ylsulfonyl)amino]phenyl]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[4-[2-hydroxyethyl(1H-indol-3-ylsulfonyl)amino]phenyl]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[4-[2-hydroxyethyl(1H-indol-3-ylsulfonyl)amino]phenyl]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[4-[2-hydroxyethyl(1H-indol-3-ylsulfonyl)amino]phenyl]-2-oxoethyl] ester IUPAC Name: S-[2-[4-[2-hydroxyethyl(1H-indol-3-ylsulfonyl)amino]phenyl]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[4-[2-hydroxyethyl(1H-indol-3-ylsulfonyl)amino]phenyl]-2-keto-ethyl] ester Formula: C20H20N2O5S2 MolecularWeight: 432.5132

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)C1=CC=C(C=C1)N(CCO)S(=O)(=O)C2=CNC3=CC=CC=C32

Isomeric SMILES

CC(=O)SCC(=O)C1=CC=C(C=C1)N(CCO)S(=O)(=O)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C20H20N2O5S2/c1-14(24)28-13-19(25)15-6-8-16(9-7-15)22(10-11-23)29(26,27)20-12-21-18-5-3-2-4-17(18)20/h2-9,12,21,23H,10-11,13H2,1H3