N-[(4-bromanyl-2-ethyl-pyrazol-3-yl)methyl]-5-[(4-propylphenoxy)methyl]furan-2-carboxamide

Systemtic Name: N-[(4-bromanyl-2-ethyl-pyrazol-3-yl)methyl]-5-[(4-propylphenoxy)methyl]furan-2-carboxamide Openeye Name: N-[(4-bromo-2-ethyl-pyrazol-3-yl)methyl]-5-[(4-propylphenoxy)methyl]furan-2-carboxamide CAS Name: N-[(4-bromo-2-ethyl-3-pyrazolyl)methyl]-5-[(4-propylphenoxy)methyl]-2-furancarboxamide IUPAC Name: N-[(4-bromo-2-ethylpyrazol-3-yl)methyl]-5-[(4-propylphenoxy)methyl]furan-2-carboxamide Traditional Name: N-[(4-bromo-2-ethyl-pyrazol-3-yl)methyl]-5-[(4-propylphenoxy)methyl]-2-furamide Formula: C21H24BrN3O3 MolecularWeight: 446.33756

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NCC3=C(C=NN3CC)Br

Isomeric SMILES

CCCC1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NCC3=C(C=NN3CC)Br

InChI

InChI=1S/C21H24BrN3O3/c1-3-5-15-6-8-16(9-7-15)27-14-17-10-11-20(28-17)21(26)23-13-19-18(22)12-24-25(19)4-2/h6-12H,3-5,13-14H2,1-2H3,(H,23,26)