3-[(5-nitro-2-oxidanyl-phenyl)methylamino]-N-[3-(trifluoromethyl)phenyl]thiophene-2-carboxamide

Systemtic Name: 3-[(5-nitro-2-oxidanyl-phenyl)methylamino]-N-[3-(trifluoromethyl)phenyl]thiophene-2-carboxamide Openeye Name: 3-[(2-hydroxy-5-nitro-phenyl)methylamino]-N-[3-(trifluoromethyl)phenyl]thiophene-2-carboxamide CAS Name: 3-[(2-hydroxy-5-nitrophenyl)methylamino]-N-[3-(trifluoromethyl)phenyl]-2-thiophenecarboxamide IUPAC Name: 3-[(2-hydroxy-5-nitrophenyl)methylamino]-N-[3-(trifluoromethyl)phenyl]thiophene-2-carboxamide Traditional Name: 3-[(2-hydroxy-5-nitro-benzyl)amino]-N-[3-(trifluoromethyl)phenyl]thiophene-2-carboxamide Formula: C19H14F3N3O4S MolecularWeight: 437.39237

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=C(C=CS2)NCC3=C(C=CC(=C3)[N+](=O)[O-])O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=C(C=CS2)NCC3=C(C=CC(=C3)[N+](=O)[O-])O)C(F)(F)F

InChI

InChI=1S/C19H14F3N3O4S/c20-19(21,22)12-2-1-3-13(9-12)24-18(27)17-15(6-7-30-17)23-10-11-8-14(25(28)29)4-5-16(11)26/h1-9,23,26H,10H2,(H,24,27)