N-(4-methoxy-2-nitro-phenyl)-4-[5-thiophen-2-yl-3-(trifluoromethyl)pyrazol-1-yl]benzamide

Systemtic Name: N-(4-methoxy-2-nitro-phenyl)-4-[5-thiophen-2-yl-3-(trifluoromethyl)pyrazol-1-yl]benzamide Openeye Name: N-(4-methoxy-2-nitro-phenyl)-4-[5-(2-thienyl)-3-(trifluoromethyl)pyrazol-1-yl]benzamide CAS Name: N-(4-methoxy-2-nitrophenyl)-4-[5-thiophen-2-yl-3-(trifluoromethyl)-1-pyrazolyl]benzamide IUPAC Name: N-(4-methoxy-2-nitrophenyl)-4-[5-thiophen-2-yl-3-(trifluoromethyl)pyrazol-1-yl]benzamide Traditional Name: N-(4-methoxy-2-nitro-phenyl)-4-[5-(2-thienyl)-3-(trifluoromethyl)pyrazol-1-yl]benzamide Formula: C22H15F3N4O4S MolecularWeight: 488.43911

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C(=CC(=N3)C(F)(F)F)C4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C(=CC(=N3)C(F)(F)F)C4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C22H15F3N4O4S/c1-33-15-8-9-16(17(11-15)29(31)32)26-21(30)13-4-6-14(7-5-13)28-18(19-3-2-10-34-19)12-20(27-28)22(23,24)25/h2-12H,1H3,(H,26,30)