N-[3-(4-bromanylpyrazol-1-yl)propyl]-3-[(4-tert-butylphenoxy)methyl]benzamide

Systemtic Name: N-[3-(4-bromanylpyrazol-1-yl)propyl]-3-[(4-tert-butylphenoxy)methyl]benzamide Openeye Name: N-[3-(4-bromopyrazol-1-yl)propyl]-3-[(4-tert-butylphenoxy)methyl]benzamide CAS Name: N-[3-(4-bromo-1-pyrazolyl)propyl]-3-[(4-tert-butylphenoxy)methyl]benzamide IUPAC Name: N-[3-(4-bromopyrazol-1-yl)propyl]-3-[(4-tert-butylphenoxy)methyl]benzamide Traditional Name: N-[3-(4-bromopyrazol-1-yl)propyl]-3-[(4-tert-butylphenoxy)methyl]benzamide Formula: C24H28BrN3O2 MolecularWeight: 470.40202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)NCCCN3C=C(C=N3)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)NCCCN3C=C(C=N3)Br

InChI

InChI=1S/C24H28BrN3O2/c1-24(2,3)20-8-10-22(11-9-20)30-17-18-6-4-7-19(14-18)23(29)26-12-5-13-28-16-21(25)15-27-28/h4,6-11,14-16H,5,12-13,17H2,1-3H3,(H,26,29)