5-(4-methylsulfonylphenoxy)-6-(oxolan-2-yl)-2-pyridin-2-yl-1H-benzimidazole

Systemtic Name: 5-(4-methylsulfonylphenoxy)-6-(oxolan-2-yl)-2-pyridin-2-yl-1H-benzimidazole Openeye Name: 5-(4-methylsulfonylphenoxy)-2-(2-pyridyl)-6-tetrahydrofuran-2-yl-1H-benzimidazole CAS Name: 5-(4-methylsulfonylphenoxy)-6-(2-oxolanyl)-2-(2-pyridinyl)-1H-benzimidazole IUPAC Name: 5-(4-methylsulfonylphenoxy)-6-(oxolan-2-yl)-2-pyridin-2-yl-1H-benzimidazole Traditional Name: 5-(4-mesylphenoxy)-2-(2-pyridyl)-6-(tetrahydrofuryl)-1H-benzimidazole Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)OC2=CC3=C(C=C2C4CCCO4)NC(=N3)C5=CC=CC=N5

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)OC2=CC3=C(C=C2C4CCCO4)NC(=N3)C5=CC=CC=N5

InChI

InChI=1S/C23H21N3O4S/c1-31(27,28)16-9-7-15(8-10-16)30-22-14-20-19(13-17(22)21-6-4-12-29-21)25-23(26-20)18-5-2-3-11-24-18/h2-3,5,7-11,13-14,21H,4,6,12H2,1H3,(H,25,26)