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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-5-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-2-furancarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]furan-2-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-2-furamide Formula: C18H16BrN3O4 MolecularWeight: 418.24134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NC3=CC4=C(C=C3)OCO4)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NC3=CC4=C(C=C3)OCO4)C)Br

InChI

InChI=1S/C18H16BrN3O4/c1-10-17(19)11(2)22(21-10)8-13-4-6-15(26-13)18(23)20-12-3-5-14-16(7-12)25-9-24-14/h3-7H,8-9H2,1-2H3,(H,20,23)