N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide

Systemtic Name: N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide Openeye Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide CAS Name: N-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide IUPAC Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide Traditional Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide Formula: C21H18BrN5O2 MolecularWeight: 452.30392

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NNC(=C2)C(=O)NC3=CC=CC(=C3)CN4C=C(C=N4)Br

Isomeric SMILES

COC1=CC=CC(=C1)C2=NNC(=C2)C(=O)NC3=CC=CC(=C3)CN4C=C(C=N4)Br

InChI

InChI=1S/C21H18BrN5O2/c1-29-18-7-3-5-15(9-18)19-10-20(26-25-19)21(28)24-17-6-2-4-14(8-17)12-27-13-16(22)11-23-27/h2-11,13H,12H2,1H3,(H,24,28)(H,25,26)