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

Systemtic Name: N-[3-(4-bromanylpyrazol-1-yl)propyl]-5-[(3,5-dimethylphenoxy)methyl]furan-2-carboxamide Openeye Name: N-[3-(4-bromopyrazol-1-yl)propyl]-5-[(3,5-dimethylphenoxy)methyl]furan-2-carboxamide CAS Name: N-[3-(4-bromo-1-pyrazolyl)propyl]-5-[(3,5-dimethylphenoxy)methyl]-2-furancarboxamide IUPAC Name: N-[3-(4-bromopyrazol-1-yl)propyl]-5-[(3,5-dimethylphenoxy)methyl]furan-2-carboxamide Traditional Name: N-[3-(4-bromopyrazol-1-yl)propyl]-5-[(3,5-dimethylphenoxy)methyl]-2-furamide Formula: C20H22BrN3O3 MolecularWeight: 432.31098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC2=CC=C(O2)C(=O)NCCCN3C=C(C=N3)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC2=CC=C(O2)C(=O)NCCCN3C=C(C=N3)Br)C

InChI

InChI=1S/C20H22BrN3O3/c1-14-8-15(2)10-18(9-14)26-13-17-4-5-19(27-17)20(25)22-6-3-7-24-12-16(21)11-23-24/h4-5,8-12H,3,6-7,13H2,1-2H3,(H,22,25)