methyl 2-[(4-methoxypyridin-2-yl)methylsulfanyl]-1H-thieno[3,4-d]imidazole-4-carboxylate

Systemtic Name: methyl 2-[(4-methoxypyridin-2-yl)methylsulfanyl]-1H-thieno[3,4-d]imidazole-4-carboxylate Openeye Name: methyl 2-[(4-methoxy-2-pyridyl)methylsulfanyl]-1H-thieno[3,4-d]imidazole-4-carboxylate CAS Name: 2-[(4-methoxy-2-pyridinyl)methylthio]-1H-thieno[3,4-d]imidazole-4-carboxylic acid methyl ester IUPAC Name: methyl 2-[(4-methoxypyridin-2-yl)methylsulfanyl]-1H-thieno[3,4-d]imidazole-4-carboxylate Traditional Name: 2-[(4-methoxy-2-pyridyl)methylthio]-1H-thien[3,4-d]imidazole-4-carboxylic acid methyl ester Formula: C14H13N3O3S2 MolecularWeight: 335.40132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC=C1)CSC2=NC3=C(SC=C3N2)C(=O)OC

Isomeric SMILES

COC1=CC(=NC=C1)CSC2=NC3=C(SC=C3N2)C(=O)OC

InChI

InChI=1S/C14H13N3O3S2/c1-19-9-3-4-15-8(5-9)6-22-14-16-10-7-21-12(11(10)17-14)13(18)20-2/h3-5,7H,6H2,1-2H3,(H,16,17)