2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-N,N,1-triethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-N,N,1-triethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]-N,N,1-triethyl-benzimidazole-5-sulfonamide CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]-N,N,1-triethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]-N,N,1-triethylbenzimidazole-5-sulfonamide Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]-N,N,1-triethyl-benzimidazole-5-sulfonamide Formula: C23H29N3O4S2 MolecularWeight: 475.62406

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC3=C(C=CC(=C3)C(=O)C)OC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC3=C(C=CC(=C3)C(=O)C)OC

InChI

InChI=1S/C23H29N3O4S2/c1-6-25(7-2)32(28,29)19-10-11-21-20(14-19)24-23(26(21)8-3)31-15-18-13-17(16(4)27)9-12-22(18)30-5/h9-14H,6-8,15H2,1-5H3