ethyl 2-(1H-benzimidazol-2-ylsulfinylmethyl)-3-dimethoxyphosphoryl-4-oxidanyl-5-oxidanylidene-furan-2-carboxylate

Systemtic Name: ethyl 2-(1H-benzimidazol-2-ylsulfinylmethyl)-3-dimethoxyphosphoryl-4-oxidanyl-5-oxidanylidene-furan-2-carboxylate Openeye Name: ethyl 2-(1H-benzimidazol-2-ylsulfinylmethyl)-3-dimethoxyphosphoryl-4-hydroxy-5-oxo-furan-2-carboxylate CAS Name: 2-(1H-benzimidazol-2-ylsulfinylmethyl)-3-dimethoxyphosphoryl-4-hydroxy-5-oxo-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 2-(1H-benzimidazol-2-ylsulfinylmethyl)-3-dimethoxyphosphoryl-4-hydroxy-5-oxofuran-2-carboxylate Traditional Name: 2-(1H-benzimidazol-2-ylsulfinylmethyl)-3-dimethoxyphosphoryl-4-hydroxy-5-keto-furan-2-carboxylic acid ethyl ester Formula: C17H19N2O9PS MolecularWeight: 458.379521

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(=C(C(=O)O1)O)P(=O)(OC)OC)CS(=O)C2=NC3=CC=CC=C3N2

Isomeric SMILES

CCOC(=O)C1(C(=C(C(=O)O1)O)P(=O)(OC)OC)CS(=O)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C17H19N2O9PS/c1-4-27-15(22)17(13(12(20)14(21)28-17)29(23,25-2)26-3)9-30(24)16-18-10-7-5-6-8-11(10)19-16/h5-8,20H,4,9H2,1-3H3,(H,18,19)