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

Systemtic Name: 1-acetyloxyethyl 2-[(5-methylpyridin-2-yl)methylsulfanyl]thieno[3,4-d]imidazole-3-carboxylate Openeye Name: 1-acetoxyethyl 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 1-acetyloxyethyl ester IUPAC Name: 1-acetyloxyethyl 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 1-acetoxyethyl ester Formula: C17H17N3O4S2 MolecularWeight: 391.46458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)CSC2=NC3=CSC=C3N2C(=O)OC(C)OC(=O)C

Isomeric SMILES

CC1=CN=C(C=C1)CSC2=NC3=CSC=C3N2C(=O)OC(C)OC(=O)C

InChI

InChI=1S/C17H17N3O4S2/c1-10-4-5-13(18-6-10)7-26-16-19-14-8-25-9-15(14)20(16)17(22)24-12(3)23-11(2)21/h4-6,8-9,12H,7H2,1-3H3