S-[2-[4-[methyl(pyridin-4-ylsulfonyl)amino]phenyl]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[4-[methyl(pyridin-4-ylsulfonyl)amino]phenyl]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[4-[methyl(4-pyridylsulfonyl)amino]phenyl]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[4-[methyl(pyridin-4-ylsulfonyl)amino]phenyl]-2-oxoethyl] ester IUPAC Name: S-[2-[4-[methyl(pyridin-4-ylsulfonyl)amino]phenyl]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-keto-2-[4-[methyl(4-pyridylsulfonyl)amino]phenyl]ethyl] ester Formula: C16H16N2O4S2 MolecularWeight: 364.43924

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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=CC=NC=C2

Isomeric SMILES

CC(=O)SCC(=O)C1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC=NC=C2

InChI

InChI=1S/C16H16N2O4S2/c1-12(19)23-11-16(20)13-3-5-14(6-4-13)18(2)24(21,22)15-7-9-17-10-8-15/h3-10H,11H2,1-2H3