S-[2-[4-(2,3-dihydro-1H-benzimidazol-5-ylsulfonylamino)phenyl]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[4-(2,3-dihydro-1H-benzimidazol-5-ylsulfonylamino)phenyl]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[4-(2,3-dihydro-1H-benzimidazol-5-ylsulfonylamino)phenyl]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[4-(2,3-dihydro-1H-benzimidazol-5-ylsulfonylamino)phenyl]-2-oxoethyl] ester IUPAC Name: S-[2-[4-(2,3-dihydro-1H-benzimidazol-5-ylsulfonylamino)phenyl]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[4-(2,3-dihydro-1H-benzimidazol-5-ylsulfonylamino)phenyl]-2-keto-ethyl] ester Formula: C17H17N3O4S2 MolecularWeight: 391.46458

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)NCN3

Isomeric SMILES

CC(=O)SCC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)NCN3

InChI

InChI=1S/C17H17N3O4S2/c1-11(21)25-9-17(22)12-2-4-13(5-3-12)20-26(23,24)14-6-7-15-16(8-14)19-10-18-15/h2-8,18-20H,9-10H2,1H3