N-[1-(5-bromanylpyridin-3-yl)butyl]-1-(4-chlorophenyl)-5-methyl-pyrazole-4-carboxamide

Systemtic Name: N-[1-(5-bromanylpyridin-3-yl)butyl]-1-(4-chlorophenyl)-5-methyl-pyrazole-4-carboxamide Openeye Name: N-[1-(5-bromo-3-pyridyl)butyl]-1-(4-chlorophenyl)-5-methyl-pyrazole-4-carboxamide CAS Name: N-[1-(5-bromo-3-pyridinyl)butyl]-1-(4-chlorophenyl)-5-methyl-4-pyrazolecarboxamide IUPAC Name: N-[1-(5-bromopyridin-3-yl)butyl]-1-(4-chlorophenyl)-5-methylpyrazole-4-carboxamide Traditional Name: N-[1-(5-bromo-3-pyridyl)butyl]-1-(4-chlorophenyl)-5-methyl-pyrazole-4-carboxamide Formula: C20H20BrClN4O MolecularWeight: 447.756

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC(=CN=C1)Br)NC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCCC(C1=CC(=CN=C1)Br)NC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C20H20BrClN4O/c1-3-4-19(14-9-15(21)11-23-10-14)25-20(27)18-12-24-26(13(18)2)17-7-5-16(22)6-8-17/h5-12,19H,3-4H2,1-2H3,(H,25,27)