N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-1-[(2,6-dimethoxyphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-1-[(2,6-dimethoxyphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-1-[(2,6-dimethoxyphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-1-[(2,6-dimethoxyphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-1-[(2,6-dimethoxyphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-1-[(2,6-dimethoxyphenoxy)methyl]pyrazole-3-carboxamide Formula: C23H22BrN5O4 MolecularWeight: 512.35588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)OCN2C=CC(=N2)C(=O)NC3=CC=CC(=C3)CN4C=C(C=N4)Br

Isomeric SMILES

COC1=C(C(=CC=C1)OC)OCN2C=CC(=N2)C(=O)NC3=CC=CC(=C3)CN4C=C(C=N4)Br

InChI

InChI=1S/C23H22BrN5O4/c1-31-20-7-4-8-21(32-2)22(20)33-15-28-10-9-19(27-28)23(30)26-18-6-3-5-16(11-18)13-29-14-17(24)12-25-29/h3-12,14H,13,15H2,1-2H3,(H,26,30)