1-[(4-bromanylphenoxy)methyl]-N-(2-methylquinolin-4-yl)pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanylphenoxy)methyl]-N-(2-methylquinolin-4-yl)pyrazole-3-carboxamide Openeye Name: 1-[(4-bromophenoxy)methyl]-N-(2-methyl-4-quinolyl)pyrazole-3-carboxamide CAS Name: 1-[(4-bromophenoxy)methyl]-N-(2-methyl-4-quinolinyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromophenoxy)methyl]-N-(2-methylquinolin-4-yl)pyrazole-3-carboxamide Traditional Name: 1-[(4-bromophenoxy)methyl]-N-(2-methyl-4-quinolyl)pyrazole-3-carboxamide Formula: C21H17BrN4O2 MolecularWeight: 437.28928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C3=NN(C=C3)COC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C3=NN(C=C3)COC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H17BrN4O2/c1-14-12-20(17-4-2-3-5-18(17)23-14)24-21(27)19-10-11-26(25-19)13-28-16-8-6-15(22)7-9-16/h2-12H,13H2,1H3,(H,23,24,27)