1-ethyl-2-[2-[4-(methylsulfonylamino)phenyl]-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-sulfonamide

Systemtic Name: 1-ethyl-2-[2-[4-(methylsulfonylamino)phenyl]-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-sulfonamide Openeye Name: 1-ethyl-2-[2-[4-(methanesulfonamido)phenyl]-2-oxo-ethyl]sulfanyl-benzimidazole-5-sulfonamide CAS Name: 1-ethyl-2-[[2-[4-(methanesulfonamido)phenyl]-2-oxoethyl]thio]-5-benzimidazolesulfonamide IUPAC Name: 1-ethyl-2-[2-[4-(methanesulfonamido)phenyl]-2-oxoethyl]sulfanylbenzimidazole-5-sulfonamide Traditional Name: 1-ethyl-2-[[2-keto-2-[4-(methanesulfonamido)phenyl]ethyl]thio]benzimidazole-5-sulfonamide Formula: C18H20N4O5S3 MolecularWeight: 468.5702

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)C3=CC=C(C=C3)NS(=O)(=O)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)C3=CC=C(C=C3)NS(=O)(=O)C

InChI

InChI=1S/C18H20N4O5S3/c1-3-22-16-9-8-14(30(19,26)27)10-15(16)20-18(22)28-11-17(23)12-4-6-13(7-5-12)21-29(2,24)25/h4-10,21H,3,11H2,1-2H3,(H2,19,26,27)