N-(5-bromanylpyridin-2-yl)-1-[(4-tert-butylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-1-[(4-tert-butylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(5-bromo-2-pyridyl)-1-[(4-tert-butylphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(5-bromo-2-pyridinyl)-1-[(4-tert-butylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(5-bromopyridin-2-yl)-1-[(4-tert-butylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(5-bromo-2-pyridyl)-1-[(4-tert-butylphenoxy)methyl]pyrazole-3-carboxamide Formula: C20H21BrN4O2 MolecularWeight: 429.31034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=NC=C(C=C3)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=NC=C(C=C3)Br

InChI

InChI=1S/C20H21BrN4O2/c1-20(2,3)14-4-7-16(8-5-14)27-13-25-11-10-17(24-25)19(26)23-18-9-6-15(21)12-22-18/h4-12H,13H2,1-3H3,(H,22,23,26)