ethyl 2-azanyl-5-(3-ethanoylphenyl)-4-[3-(trifluoromethyl)phenyl]thiophene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-5-(3-ethanoylphenyl)-4-[3-(trifluoromethyl)phenyl]thiophene-3-carboxylate Openeye Name: ethyl 5-(3-acetylphenyl)-2-amino-4-[3-(trifluoromethyl)phenyl]thiophene-3-carboxylate CAS Name: 5-(3-acetylphenyl)-2-amino-4-[3-(trifluoromethyl)phenyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-acetylphenyl)-2-amino-4-[3-(trifluoromethyl)phenyl]thiophene-3-carboxylate Traditional Name: 5-(3-acetylphenyl)-2-amino-4-[3-(trifluoromethyl)phenyl]thiophene-3-carboxylic acid ethyl ester Formula: C22H18F3NO3S MolecularWeight: 433.44343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC(=CC=C2)C(F)(F)F)C3=CC(=CC=C3)C(=O)C)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC(=CC=C2)C(F)(F)F)C3=CC(=CC=C3)C(=O)C)N

InChI

InChI=1S/C22H18F3NO3S/c1-3-29-21(28)18-17(14-7-5-9-16(11-14)22(23,24)25)19(30-20(18)26)15-8-4-6-13(10-15)12(2)27/h4-11H,3,26H2,1-2H3