1-[2-(pyridin-2-ylmethylsulfinyl)benzimidazol-1-yl]ethyl benzoate

Systemtic Name: 1-[2-(pyridin-2-ylmethylsulfinyl)benzimidazol-1-yl]ethyl benzoate Openeye Name: 1-[2-(2-pyridylmethylsulfinyl)benzimidazol-1-yl]ethyl benzoate CAS Name: benzoic acid 1-[2-(2-pyridinylmethylsulfinyl)-1-benzimidazolyl]ethyl ester IUPAC Name: 1-[2-(pyridin-2-ylmethylsulfinyl)benzimidazol-1-yl]ethyl benzoate Traditional Name: benzoic acid 1-[2-(2-pyridylmethylsulfinyl)benzimidazol-1-yl]ethyl ester Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1C2=CC=CC=C2N=C1S(=O)CC3=CC=CC=N3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(N1C2=CC=CC=C2N=C1S(=O)CC3=CC=CC=N3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H19N3O3S/c1-16(28-21(26)17-9-3-2-4-10-17)25-20-13-6-5-12-19(20)24-22(25)29(27)15-18-11-7-8-14-23-18/h2-14,16H,15H2,1H3