S-[2-[4-[methyl-(4-phenylphenyl)sulfonyl-amino]phenyl]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[4-[methyl-(4-phenylphenyl)sulfonyl-amino]phenyl]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[4-[methyl-(4-phenylphenyl)sulfonyl-amino]phenyl]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[4-[methyl-(4-phenylphenyl)sulfonylamino]phenyl]-2-oxoethyl] ester IUPAC Name: S-[2-[4-[methyl-(4-phenylphenyl)sulfonylamino]phenyl]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-keto-2-[4-[methyl-(4-phenylphenyl)sulfonyl-amino]phenyl]ethyl] ester Formula: C23H21NO4S2 MolecularWeight: 439.54714

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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=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C23H21NO4S2/c1-17(25)29-16-23(26)20-8-12-21(13-9-20)24(2)30(27,28)22-14-10-19(11-15-22)18-6-4-3-5-7-18/h3-15H,16H2,1-2H3