O1-methyl O4-[[2-(pyridin-2-ylmethylsulfinyl)benzimidazol-1-yl]methyl] butanedioate

Systemtic Name: O1-methyl O4-[[2-(pyridin-2-ylmethylsulfinyl)benzimidazol-1-yl]methyl] butanedioate Openeye Name: O1-methyl O4-[[2-(2-pyridylmethylsulfinyl)benzimidazol-1-yl]methyl] butanedioate CAS Name: butanedioic acid O1-methyl ester O4-[[2-(2-pyridinylmethylsulfinyl)-1-benzimidazolyl]methyl] ester IUPAC Name: 1-O-methyl 4-O-[[2-(pyridin-2-ylmethylsulfinyl)benzimidazol-1-yl]methyl] butanedioate Traditional Name: succinic acid O1-methyl ester O4-[[2-(2-pyridylmethylsulfinyl)benzimidazol-1-yl]methyl] ester Formula: C19H19N3O5S MolecularWeight: 401.43626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)OCN1C2=CC=CC=C2N=C1S(=O)CC3=CC=CC=N3

Isomeric SMILES

COC(=O)CCC(=O)OCN1C2=CC=CC=C2N=C1S(=O)CC3=CC=CC=N3

InChI

InChI=1S/C19H19N3O5S/c1-26-17(23)9-10-18(24)27-13-22-16-8-3-2-7-15(16)21-19(22)28(25)12-14-6-4-5-11-20-14/h2-8,11H,9-10,12-13H2,1H3