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

Systemtic Name: 3-[(1-methyl-4-nitro-pyrazol-3-yl)carbonylamino]-4-phenyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-[(1-methyl-4-nitro-pyrazole-3-carbonyl)amino]-4-phenyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-[[(1-methyl-4-nitro-3-pyrazolyl)-oxomethyl]amino]-4-phenyl-6-(trifluoromethyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-[(1-methyl-4-nitropyrazole-3-carbonyl)amino]-4-phenyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-[(1-methyl-4-nitro-pyrazole-3-carbonyl)amino]-4-phenyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide Formula: C20H13F3N6O4S MolecularWeight: 490.41523

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=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

CN1C=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/C20H13F3N6O4S/c1-28-8-11(29(32)33)14(27-28)18(31)26-15-13-10(9-5-3-2-4-6-9)7-12(20(21,22)23)25-19(13)34-16(15)17(24)30/h2-8H,1H3,(H2,24,30)(H,26,31)