ethyl 4-[2-oxidanylidene-2-[[2-(trifluoromethyl)-3H-benzimidazol-5-yl]amino]ethyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-oxidanylidene-2-[[2-(trifluoromethyl)-3H-benzimidazol-5-yl]amino]ethyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-oxo-2-[[2-(trifluoromethyl)-3H-benzimidazol-5-yl]amino]ethyl]piperazine-1-carboxylate CAS Name: 4-[2-oxo-2-[[2-(trifluoromethyl)-3H-benzimidazol-5-yl]amino]ethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-oxo-2-[[2-(trifluoromethyl)-3H-benzimidazol-5-yl]amino]ethyl]piperazine-1-carboxylate Traditional Name: 4-[2-keto-2-[[2-(trifluoromethyl)-3H-benzimidazol-5-yl]amino]ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H20F3N5O3 MolecularWeight: 399.36761

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC(=O)NC2=CC3=C(C=C2)N=C(N3)C(F)(F)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC(=O)NC2=CC3=C(C=C2)N=C(N3)C(F)(F)F

InChI

InChI=1S/C17H20F3N5O3/c1-2-28-16(27)25-7-5-24(6-8-25)10-14(26)21-11-3-4-12-13(9-11)23-15(22-12)17(18,19)20/h3-4,9H,2,5-8,10H2,1H3,(H,21,26)(H,22,23)