1-[2-[2-(1H-benzimidazol-2-ylsulfinyl)phenyl]pyridin-4-yl]oxypropan-2-one

Systemtic Name: 1-[2-[2-(1H-benzimidazol-2-ylsulfinyl)phenyl]pyridin-4-yl]oxypropan-2-one Openeye Name: 1-[[2-[2-(1H-benzimidazol-2-ylsulfinyl)phenyl]-4-pyridyl]oxy]propan-2-one CAS Name: 1-[[2-[2-(1H-benzimidazol-2-ylsulfinyl)phenyl]-4-pyridinyl]oxy]-2-propanone IUPAC Name: 1-[2-[2-(1H-benzimidazol-2-ylsulfinyl)phenyl]pyridin-4-yl]oxypropan-2-one Traditional Name: 1-[[2-[2-(1H-benzimidazol-2-ylsulfinyl)phenyl]-4-pyridyl]oxy]acetone Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC1=CC(=NC=C1)C2=CC=CC=C2S(=O)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CC(=O)COC1=CC(=NC=C1)C2=CC=CC=C2S(=O)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H17N3O3S/c1-14(25)13-27-15-10-11-22-19(12-15)16-6-2-5-9-20(16)28(26)21-23-17-7-3-4-8-18(17)24-21/h2-12H,13H2,1H3,(H,23,24)