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

Systemtic Name: (phenylmethyl) 2-[(4-methoxypyridin-2-yl)methylsulfanyl]thieno[3,4-d]imidazole-3-carboxylate Openeye Name: benzyl 2-[(4-methoxy-2-pyridyl)methylsulfanyl]thieno[3,4-d]imidazole-3-carboxylate CAS Name: 2-[(4-methoxy-2-pyridinyl)methylthio]-3-thieno[3,4-d]imidazolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(4-methoxypyridin-2-yl)methylsulfanyl]thieno[3,4-d]imidazole-3-carboxylate Traditional Name: 2-[(4-methoxy-2-pyridyl)methylthio]thien[3,4-d]imidazole-3-carboxylic acid benzyl ester Formula: C20H17N3O3S2 MolecularWeight: 411.49728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC=C1)CSC2=NC3=CSC=C3N2C(=O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=NC=C1)CSC2=NC3=CSC=C3N2C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C20H17N3O3S2/c1-25-16-7-8-21-15(9-16)11-28-19-22-17-12-27-13-18(17)23(19)20(24)26-10-14-5-3-2-4-6-14/h2-9,12-13H,10-11H2,1H3