5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[(3,4-diethoxyphenyl)methyl]furan-2-carboxamide

Systemtic Name: 5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[(3,4-diethoxyphenyl)methyl]furan-2-carboxamide Openeye Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[(3,4-diethoxyphenyl)methyl]furan-2-carboxamide CAS Name: 5-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-[(3,4-diethoxyphenyl)methyl]-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-[(3,4-diethoxyphenyl)methyl]furan-2-carboxamide Traditional Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(3,4-diethoxybenzyl)-2-furamide Formula: C22H26BrN3O4 MolecularWeight: 476.36354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C2=CC=C(O2)CN3C(=C(C(=N3)C)Br)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)C2=CC=C(O2)CN3C(=C(C(=N3)C)Br)C)OCC

InChI

InChI=1S/C22H26BrN3O4/c1-5-28-18-9-7-16(11-20(18)29-6-2)12-24-22(27)19-10-8-17(30-19)13-26-15(4)21(23)14(3)25-26/h7-11H,5-6,12-13H2,1-4H3,(H,24,27)