methyl 6-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)-3-nitro-thieno[2,3-b]pyridine-5-carboxylate

Systemtic Name: methyl 6-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)-3-nitro-thieno[2,3-b]pyridine-5-carboxylate Openeye Name: methyl 6-(4-isopropyl-4-methyl-5-oxo-1H-imidazol-2-yl)-3-nitro-thieno[2,3-b]pyridine-5-carboxylate CAS Name: 6-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-3-nitro-5-thieno[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-3-nitrothieno[2,3-b]pyridine-5-carboxylate Traditional Name: 6-(4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)-3-nitro-thieno[2,3-b]pyridine-5-carboxylic acid methyl ester Formula: C16H16N4O5S MolecularWeight: 376.38704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C(=O)NC(=N1)C2=C(C=C3C(=CSC3=N2)[N+](=O)[O-])C(=O)OC)C

Isomeric SMILES

CC(C)C1(C(=O)NC(=N1)C2=C(C=C3C(=CSC3=N2)[N+](=O)[O-])C(=O)OC)C

InChI

InChI=1S/C16H16N4O5S/c1-7(2)16(3)15(22)18-12(19-16)11-9(14(21)25-4)5-8-10(20(23)24)6-26-13(8)17-11/h5-7H,1-4H3,(H,18,19,22)