ethyl 2-azanyl-4-(4-cyanophenyl)-5-ethanoyl-1-[3-iodanyl-5-(trifluoromethyl)phenyl]-6-methyl-4H-pyridine-3-carboxylate

Systemtic Name: ethyl 2-azanyl-4-(4-cyanophenyl)-5-ethanoyl-1-[3-iodanyl-5-(trifluoromethyl)phenyl]-6-methyl-4H-pyridine-3-carboxylate Openeye Name: ethyl 5-acetyl-2-amino-4-(4-cyanophenyl)-1-[3-iodo-5-(trifluoromethyl)phenyl]-6-methyl-4H-pyridine-3-carboxylate CAS Name: 5-acetyl-2-amino-4-(4-cyanophenyl)-1-[3-iodo-5-(trifluoromethyl)phenyl]-6-methyl-4H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-amino-4-(4-cyanophenyl)-1-[3-iodo-5-(trifluoromethyl)phenyl]-6-methyl-4H-pyridine-3-carboxylate Traditional Name: 5-acetyl-2-amino-4-(4-cyanophenyl)-1-[3-iodo-5-(trifluoromethyl)phenyl]-6-methyl-4H-pyridine-3-carboxylic acid ethyl ester Formula: C25H21F3IN3O3 MolecularWeight: 595.35222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H21F3IN3O3/c1-4-35-24(34)22-21(16-7-5-15(12-30)6-8-16)20(14(3)33)13(2)32(23(22)31)19-10-17(25(26,27)28)9-18(29)11-19/h5-11,21H,4,31H2,1-3H3