S-[2-oxidanylidene-2-[1-(phenylsulfonyl)indol-5-yl]ethyl] ethanethioate

Systemtic Name: S-[2-oxidanylidene-2-[1-(phenylsulfonyl)indol-5-yl]ethyl] ethanethioate Openeye Name: S-[2-[1-(benzenesulfonyl)indol-5-yl]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[1-(benzenesulfonyl)-5-indolyl]-2-oxoethyl] ester IUPAC Name: S-[2-[1-(benzenesulfonyl)indol-5-yl]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-(1-besylindol-5-yl)-2-keto-ethyl] ester Formula: C18H15NO4S2 MolecularWeight: 373.446

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)C1=CC2=C(C=C1)N(C=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)SCC(=O)C1=CC2=C(C=C1)N(C=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H15NO4S2/c1-13(20)24-12-18(21)15-7-8-17-14(11-15)9-10-19(17)25(22,23)16-5-3-2-4-6-16/h2-11H,12H2,1H3