S-[2-[4-[[4-(1-methylpiperidin-4-yl)oxyphenyl]sulfonylamino]phenyl]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[4-[[4-(1-methylpiperidin-4-yl)oxyphenyl]sulfonylamino]phenyl]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[4-[[4-[(1-methyl-4-piperidyl)oxy]phenyl]sulfonylamino]phenyl]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[4-[[4-[(1-methyl-4-piperidinyl)oxy]phenyl]sulfonylamino]phenyl]-2-oxoethyl] ester IUPAC Name: S-[2-[4-[[4-(1-methylpiperidin-4-yl)oxyphenyl]sulfonylamino]phenyl]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-keto-2-[4-[[4-[(1-methyl-4-piperidyl)oxy]phenyl]sulfonylamino]phenyl]ethyl] ester Formula: C22H26N2O5S2 MolecularWeight: 462.58224

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)OC3CCN(CC3)C

Isomeric SMILES

CC(=O)SCC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)OC3CCN(CC3)C

InChI

InChI=1S/C22H26N2O5S2/c1-16(25)30-15-22(26)17-3-5-18(6-4-17)23-31(27,28)21-9-7-19(8-10-21)29-20-11-13-24(2)14-12-20/h3-10,20,23H,11-15H2,1-2H3