(1-ethylbenzotriazol-5-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone

Systemtic Name: (1-ethylbenzotriazol-5-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: (1-ethylbenzotriazol-5-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: (1-ethyl-5-benzotriazolyl)-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (1-ethylbenzotriazol-5-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: (1-ethylbenzotriazol-5-yl)-[4-[3-(trifluoromethyl)phenyl]piperazino]methanone Formula: C20H20F3N5O MolecularWeight: 403.40091

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F)N=N1

InChI

InChI=1S/C20H20F3N5O/c1-2-28-18-7-6-14(12-17(18)24-25-28)19(29)27-10-8-26(9-11-27)16-5-3-4-15(13-16)20(21,22)23/h3-7,12-13H,2,8-11H2,1H3