2-[[4-(5,9-dioxaspiro[3.5]nonan-7-ylmethoxy)pyridin-2-yl]methylsulfinyl]-1H-benzimidazole

Systemtic Name: 2-[[4-(5,9-dioxaspiro[3.5]nonan-7-ylmethoxy)pyridin-2-yl]methylsulfinyl]-1H-benzimidazole Openeye Name: 2-[[4-(5,9-dioxaspiro[3.5]nonan-7-ylmethoxy)-2-pyridyl]methylsulfinyl]-1H-benzimidazole CAS Name: 2-[[4-(5,9-dioxaspiro[3.5]nonan-7-ylmethoxy)-2-pyridinyl]methylsulfinyl]-1H-benzimidazole IUPAC Name: 2-[[4-(5,9-dioxaspiro[3.5]nonan-7-ylmethoxy)pyridin-2-yl]methylsulfinyl]-1H-benzimidazole Traditional Name: 2-[[4-(5,9-dioxaspiro[3.5]nonan-7-ylmethoxy)-2-pyridyl]methylsulfinyl]-1H-benzimidazole Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(C1)OCC(CO2)COC3=CC(=NC=C3)CS(=O)C4=NC5=CC=CC=C5N4

Isomeric SMILES

C1CC2(C1)OCC(CO2)COC3=CC(=NC=C3)CS(=O)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C21H23N3O4S/c25-29(20-23-18-4-1-2-5-19(18)24-20)14-16-10-17(6-9-22-16)26-11-15-12-27-21(28-13-15)7-3-8-21/h1-2,4-6,9-10,15H,3,7-8,11-14H2,(H,23,24)