N-(1,3-benzodioxol-5-ylmethyl)-5-[(4-bromanylpyrazol-1-yl)methyl]furan-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[(4-bromanylpyrazol-1-yl)methyl]furan-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[(4-bromopyrazol-1-yl)methyl]furan-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[(4-bromo-1-pyrazolyl)methyl]-2-furancarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[(4-bromopyrazol-1-yl)methyl]furan-2-carboxamide Traditional Name: 5-[(4-bromopyrazol-1-yl)methyl]-N-piperonyl-2-furamide Formula: C17H14BrN3O4 MolecularWeight: 404.21476

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=C(O3)CN4C=C(C=N4)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=C(O3)CN4C=C(C=N4)Br

InChI

InChI=1S/C17H14BrN3O4/c18-12-7-20-21(8-12)9-13-2-4-15(25-13)17(22)19-6-11-1-3-14-16(5-11)24-10-23-14/h1-5,7-8H,6,9-10H2,(H,19,22)