3-[(2-ethyl-4-nitro-pyrazol-3-yl)carbonylamino]-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-[(2-ethyl-4-nitro-pyrazol-3-yl)carbonylamino]-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-[(2-ethyl-4-nitro-pyrazole-3-carbonyl)amino]-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-[[(2-ethyl-4-nitro-3-pyrazolyl)-oxomethyl]amino]-4-methyl-6-(trifluoromethyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-[(2-ethyl-4-nitropyrazole-3-carbonyl)amino]-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-[(2-ethyl-4-nitro-pyrazole-3-carbonyl)amino]-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide Formula: C16H13F3N6O4S MolecularWeight: 442.37243

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=C(SC3=C2C(=CC(=N3)C(F)(F)F)C)C(=O)N

Isomeric SMILES

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=C(SC3=C2C(=CC(=N3)C(F)(F)F)C)C(=O)N

InChI

InChI=1S/C16H13F3N6O4S/c1-3-24-11(7(5-21-24)25(28)29)14(27)23-10-9-6(2)4-8(16(17,18)19)22-15(9)30-12(10)13(20)26/h4-5H,3H2,1-2H3,(H2,20,26)(H,23,27)