N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-2,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-2,5-dimethyl-pyrazole-3-carboxamide Openeye Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-2,5-dimethyl-pyrazole-3-carboxamide CAS Name: N-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-2,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-2,5-dimethylpyrazole-3-carboxamide Traditional Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-2,5-dimethyl-pyrazole-3-carboxamide Formula: C16H16BrN5O MolecularWeight: 374.23514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=CC=CC(=C2)CN3C=C(C=N3)Br)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=CC=CC(=C2)CN3C=C(C=N3)Br)C

InChI

InChI=1S/C16H16BrN5O/c1-11-6-15(21(2)20-11)16(23)19-14-5-3-4-12(7-14)9-22-10-13(17)8-18-22/h3-8,10H,9H2,1-2H3,(H,19,23)