[2-[(3,4-dimethoxypyridin-2-yl)methylsulfinyl]-5-ethanoyl-6-methyl-benzimidazol-1-yl]methyl dihydrogen phosphate

Systemtic Name: [2-[(3,4-dimethoxypyridin-2-yl)methylsulfinyl]-5-ethanoyl-6-methyl-benzimidazol-1-yl]methyl dihydrogen phosphate Openeye Name: [5-acetyl-2-[(3,4-dimethoxy-2-pyridyl)methylsulfinyl]-6-methyl-benzimidazol-1-yl]methyl dihydrogen phosphate CAS Name: [5-acetyl-2-[(3,4-dimethoxy-2-pyridinyl)methylsulfinyl]-6-methyl-1-benzimidazolyl]methyl dihydrogen phosphate IUPAC Name: [5-acetyl-2-[(3,4-dimethoxypyridin-2-yl)methylsulfinyl]-6-methylbenzimidazol-1-yl]methyl dihydrogen phosphate Traditional Name: [5-acetyl-2-[(3,4-dimethoxy-2-pyridyl)methylsulfinyl]-6-methyl-benzimidazol-1-yl]methyl dihydrogen phosphate Formula: C19H22N3O8PS MolecularWeight: 483.432041

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C(=O)C)N=C(N2COP(=O)(O)O)S(=O)CC3=NC=CC(=C3OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1C(=O)C)N=C(N2COP(=O)(O)O)S(=O)CC3=NC=CC(=C3OC)OC

InChI

InChI=1S/C19H22N3O8PS/c1-11-7-16-14(8-13(11)12(2)23)21-19(22(16)10-30-31(24,25)26)32(27)9-15-18(29-4)17(28-3)5-6-20-15/h5-8H,9-10H2,1-4H3,(H2,24,25,26)