N-[4-acetamido-2-(trifluoromethyl)phenyl]-1-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-1-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Openeye Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-1-phenyl-5-(2-thienyl)-1,2,4-triazole-3-carboxamide CAS Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-1-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide IUPAC Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-1-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Traditional Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-1-phenyl-5-(2-thienyl)-1,2,4-triazole-3-carboxamide Formula: C22H16F3N5O2S MolecularWeight: 471.45495

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)NC(=O)C2=NN(C(=N2)C3=CC=CS3)C4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)NC(=O)C2=NN(C(=N2)C3=CC=CS3)C4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C22H16F3N5O2S/c1-13(31)26-14-9-10-17(16(12-14)22(23,24)25)27-21(32)19-28-20(18-8-5-11-33-18)30(29-19)15-6-3-2-4-7-15/h2-12H,1H3,(H,26,31)(H,27,32)