3-[(4-bromanylphenoxy)methyl]-N-[(3-tert-butyl-1H-pyrazol-5-yl)methyl]benzamide

Systemtic Name: 3-[(4-bromanylphenoxy)methyl]-N-[(3-tert-butyl-1H-pyrazol-5-yl)methyl]benzamide Openeye Name: 3-[(4-bromophenoxy)methyl]-N-[(3-tert-butyl-1H-pyrazol-5-yl)methyl]benzamide CAS Name: 3-[(4-bromophenoxy)methyl]-N-[(3-tert-butyl-1H-pyrazol-5-yl)methyl]benzamide IUPAC Name: 3-[(4-bromophenoxy)methyl]-N-[(3-tert-butyl-1H-pyrazol-5-yl)methyl]benzamide Traditional Name: 3-[(4-bromophenoxy)methyl]-N-[(3-tert-butyl-1H-pyrazol-5-yl)methyl]benzamide Formula: C22H24BrN3O2 MolecularWeight: 442.34886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NNC(=C1)CNC(=O)C2=CC(=CC=C2)COC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)(C)C1=NNC(=C1)CNC(=O)C2=CC(=CC=C2)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H24BrN3O2/c1-22(2,3)20-12-18(25-26-20)13-24-21(27)16-6-4-5-15(11-16)14-28-19-9-7-17(23)8-10-19/h4-12H,13-14H2,1-3H3,(H,24,27)(H,25,26)