1-ethyl-2-[3-oxidanylidene-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-ethyl-2-[3-oxidanylidene-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]benzimidazole-5-sulfonamide Openeye Name: 1-ethyl-2-[3-oxo-3-[4-(2-pyridyl)piperazin-1-yl]propyl]benzimidazole-5-sulfonamide CAS Name: 1-ethyl-2-[3-oxo-3-[4-(2-pyridinyl)-1-piperazinyl]propyl]-5-benzimidazolesulfonamide IUPAC Name: 1-ethyl-2-[3-oxo-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]benzimidazole-5-sulfonamide Traditional Name: 1-ethyl-2-[3-keto-3-[4-(2-pyridyl)piperazino]propyl]benzimidazole-5-sulfonamide Formula: C21H26N6O3S MolecularWeight: 442.53454

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CCC(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CCC(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C21H26N6O3S/c1-2-27-18-7-6-16(31(22,29)30)15-17(18)24-20(27)8-9-21(28)26-13-11-25(12-14-26)19-5-3-4-10-23-19/h3-7,10,15H,2,8-9,11-14H2,1H3,(H2,22,29,30)