3-[(1-ethyl-4-nitro-pyrazol-3-yl)carbonylamino]-4-phenyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-[(1-ethyl-4-nitro-pyrazol-3-yl)carbonylamino]-4-phenyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-[(1-ethyl-4-nitro-pyrazole-3-carbonyl)amino]-4-phenyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-[[(1-ethyl-4-nitro-3-pyrazolyl)-oxomethyl]amino]-4-phenyl-6-(trifluoromethyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-[(1-ethyl-4-nitropyrazole-3-carbonyl)amino]-4-phenyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-[(1-ethyl-4-nitro-pyrazole-3-carbonyl)amino]-4-phenyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide Formula: C21H15F3N6O4S MolecularWeight: 504.44181

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=C(SC3=C2C(=CC(=N3)C(F)(F)F)C4=CC=CC=C4)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=C(SC3=C2C(=CC(=N3)C(F)(F)F)C4=CC=CC=C4)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C21H15F3N6O4S/c1-2-29-9-12(30(33)34)15(28-29)19(32)27-16-14-11(10-6-4-3-5-7-10)8-13(21(22,23)24)26-20(14)35-17(16)18(25)31/h3-9H,2H2,1H3,(H2,25,31)(H,27,32)