ethyl 1-[2-azanyl-5-imidazol-1-yl-4-(trifluoromethyl)phenyl]-5-methyl-imidazole-4-carboxylate

Systemtic Name: ethyl 1-[2-azanyl-5-imidazol-1-yl-4-(trifluoromethyl)phenyl]-5-methyl-imidazole-4-carboxylate Openeye Name: ethyl 1-[2-amino-5-imidazol-1-yl-4-(trifluoromethyl)phenyl]-5-methyl-imidazole-4-carboxylate CAS Name: 1-[2-amino-5-(1-imidazolyl)-4-(trifluoromethyl)phenyl]-5-methyl-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-amino-5-imidazol-1-yl-4-(trifluoromethyl)phenyl]-5-methylimidazole-4-carboxylate Traditional Name: 1-[2-amino-5-imidazol-1-yl-4-(trifluoromethyl)phenyl]-5-methyl-imidazole-4-carboxylic acid ethyl ester Formula: C17H16F3N5O2 MolecularWeight: 379.33645

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C=N1)C2=C(C=C(C(=C2)N3C=CN=C3)C(F)(F)F)N)C

Isomeric SMILES

CCOC(=O)C1=C(N(C=N1)C2=C(C=C(C(=C2)N3C=CN=C3)C(F)(F)F)N)C

InChI

InChI=1S/C17H16F3N5O2/c1-3-27-16(26)15-10(2)25(9-23-15)14-7-13(24-5-4-22-8-24)11(6-12(14)21)17(18,19)20/h4-9H,3,21H2,1-2H3