(phenylmethyl) 2-[(5-methylpyridin-2-yl)methylsulfanyl]thieno[3,4-d]imidazole-3-carboxylate

Systemtic Name: (phenylmethyl) 2-[(5-methylpyridin-2-yl)methylsulfanyl]thieno[3,4-d]imidazole-3-carboxylate Openeye Name: benzyl 2-[(5-methyl-2-pyridyl)methylsulfanyl]thieno[3,4-d]imidazole-3-carboxylate CAS Name: 2-[(5-methyl-2-pyridinyl)methylthio]-3-thieno[3,4-d]imidazolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(5-methylpyridin-2-yl)methylsulfanyl]thieno[3,4-d]imidazole-3-carboxylate Traditional Name: 2-[(5-methyl-2-pyridyl)methylthio]thien[3,4-d]imidazole-3-carboxylic acid benzyl ester Formula: C20H17N3O2S2 MolecularWeight: 395.49788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)CSC2=NC3=CSC=C3N2C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CN=C(C=C1)CSC2=NC3=CSC=C3N2C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C20H17N3O2S2/c1-14-7-8-16(21-9-14)11-27-19-22-17-12-26-13-18(17)23(19)20(24)25-10-15-5-3-2-4-6-15/h2-9,12-13H,10-11H2,1H3