dimethyl 2-[(4-methoxypyridin-2-yl)methylsulfinyl]-1H-thieno[2,3-d]imidazole-5,6-dicarboxylate

Systemtic Name: dimethyl 2-[(4-methoxypyridin-2-yl)methylsulfinyl]-1H-thieno[2,3-d]imidazole-5,6-dicarboxylate Openeye Name: dimethyl 2-[(4-methoxy-2-pyridyl)methylsulfinyl]-1H-thieno[2,3-d]imidazole-5,6-dicarboxylate CAS Name: 2-[(4-methoxy-2-pyridinyl)methylsulfinyl]-1H-thieno[2,3-d]imidazole-5,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(4-methoxypyridin-2-yl)methylsulfinyl]-1H-thieno[2,3-d]imidazole-5,6-dicarboxylate Traditional Name: 2-[(4-methoxy-2-pyridyl)methylsulfinyl]-1H-thien[2,3-d]imidazole-5,6-dicarboxylic acid dimethyl ester Formula: C16H15N3O6S2 MolecularWeight: 409.4368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC=C1)CS(=O)C2=NC3=C(N2)C(=C(S3)C(=O)OC)C(=O)OC

Isomeric SMILES

COC1=CC(=NC=C1)CS(=O)C2=NC3=C(N2)C(=C(S3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C16H15N3O6S2/c1-23-9-4-5-17-8(6-9)7-27(22)16-18-11-10(14(20)24-2)12(15(21)25-3)26-13(11)19-16/h4-6H,7H2,1-3H3,(H,18,19)