3-[3-(4-cyanophenoxy)-2-oxidanyl-propyl]-1-ethyl-N,N-dimethyl-2-oxidanylidene-benzimidazole-5-sulfonamide

Systemtic Name: 3-[3-(4-cyanophenoxy)-2-oxidanyl-propyl]-1-ethyl-N,N-dimethyl-2-oxidanylidene-benzimidazole-5-sulfonamide Openeye Name: 3-[3-(4-cyanophenoxy)-2-hydroxy-propyl]-1-ethyl-N,N-dimethyl-2-oxo-benzimidazole-5-sulfonamide CAS Name: 3-[3-(4-cyanophenoxy)-2-hydroxypropyl]-1-ethyl-N,N-dimethyl-2-oxo-5-benzimidazolesulfonamide IUPAC Name: 3-[3-(4-cyanophenoxy)-2-hydroxypropyl]-1-ethyl-N,N-dimethyl-2-oxobenzimidazole-5-sulfonamide Traditional Name: 3-[3-(4-cyanophenoxy)-2-hydroxy-propyl]-1-ethyl-2-keto-N,N-dimethyl-benzimidazole-5-sulfonamide Formula: C21H24N4O5S MolecularWeight: 444.50406

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N(C1=O)CC(COC3=CC=C(C=C3)C#N)O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N(C1=O)CC(COC3=CC=C(C=C3)C#N)O

InChI

InChI=1S/C21H24N4O5S/c1-4-24-19-10-9-18(31(28,29)23(2)3)11-20(19)25(21(24)27)13-16(26)14-30-17-7-5-15(12-22)6-8-17/h5-11,16,26H,4,13-14H2,1-3H3