N-[(4-bromanyl-2-ethyl-pyrazol-3-yl)methyl]-1,3-diphenyl-pyrazole-4-carboxamide

Systemtic Name: N-[(4-bromanyl-2-ethyl-pyrazol-3-yl)methyl]-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-[(4-bromo-2-ethyl-pyrazol-3-yl)methyl]-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-[(4-bromo-2-ethyl-3-pyrazolyl)methyl]-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-[(4-bromo-2-ethylpyrazol-3-yl)methyl]-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-[(4-bromo-2-ethyl-pyrazol-3-yl)methyl]-1,3-diphenyl-pyrazole-4-carboxamide Formula: C22H20BrN5O MolecularWeight: 450.3311

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Br)CNC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=C(C=N1)Br)CNC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H20BrN5O/c1-2-27-20(19(23)13-25-27)14-24-22(29)18-15-28(17-11-7-4-8-12-17)26-21(18)16-9-5-3-6-10-16/h3-13,15H,2,14H2,1H3,(H,24,29)