N-[4-bromanyl-5-tert-butyl-1-methyl-2-[[(2R)-oxolan-2-yl]methyl]pyrazol-3-ylidene]-2-methyl-5-(trifluoromethyl)benzamide

Systemtic Name: N-[4-bromanyl-5-tert-butyl-1-methyl-2-[[(2R)-oxolan-2-yl]methyl]pyrazol-3-ylidene]-2-methyl-5-(trifluoromethyl)benzamide Openeye Name: N-[4-bromo-5-tert-butyl-1-methyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrazol-3-ylidene]-2-methyl-5-(trifluoromethyl)benzamide CAS Name: N-[4-bromo-5-tert-butyl-1-methyl-2-[[(2R)-2-oxolanyl]methyl]-3-pyrazolylidene]-2-methyl-5-(trifluoromethyl)benzamide IUPAC Name: N-[4-bromo-5-tert-butyl-1-methyl-2-[[(2R)-oxolan-2-yl]methyl]pyrazol-3-ylidene]-2-methyl-5-(trifluoromethyl)benzamide Traditional Name: N-[4-bromo-5-tert-butyl-1-methyl-2-[[(2R)-tetrahydrofuran-2-yl]methyl]-3-pyrazolin-3-ylidene]-2-methyl-5-(trifluoromethyl)benzamide Formula: C22H27BrF3N3O2 MolecularWeight: 502.36789

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(F)(F)F)C(=O)N=C2C(=C(N(N2CC3CCCO3)C)C(C)(C)C)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(F)(F)F)C(=O)N=C2C(=C(N(N2C[C@H]3CCCO3)C)C(C)(C)C)Br

InChI

InChI=1S/C22H27BrF3N3O2/c1-13-8-9-14(22(24,25)26)11-16(13)20(30)27-19-17(23)18(21(2,3)4)28(5)29(19)12-15-7-6-10-31-15/h8-9,11,15H,6-7,10,12H2,1-5H3/t15-/m1/s1