S-[2-oxidanylidene-2-[4-[(4-pyrazol-1-ylphenyl)sulfonylamino]phenyl]ethyl] ethanethioate

Systemtic Name: S-[2-oxidanylidene-2-[4-[(4-pyrazol-1-ylphenyl)sulfonylamino]phenyl]ethyl] ethanethioate Openeye Name: S-[2-oxo-2-[4-[(4-pyrazol-1-ylphenyl)sulfonylamino]phenyl]ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-oxo-2-[4-[[4-(1-pyrazolyl)phenyl]sulfonylamino]phenyl]ethyl] ester IUPAC Name: S-[2-oxo-2-[4-[(4-pyrazol-1-ylphenyl)sulfonylamino]phenyl]ethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-keto-2-[4-[(4-pyrazol-1-ylphenyl)sulfonylamino]phenyl]ethyl] ester Formula: C19H17N3O4S2 MolecularWeight: 415.48598

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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)N3C=CC=N3

Isomeric SMILES

CC(=O)SCC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C19H17N3O4S2/c1-14(23)27-13-19(24)15-3-5-16(6-4-15)21-28(25,26)18-9-7-17(8-10-18)22-12-2-11-20-22/h2-12,21H,13H2,1H3