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

Systemtic Name: 5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-methyl-4-oxidanyl-5-propan-2-yl-phenyl)furan-2-carboxamide Openeye Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(4-hydroxy-5-isopropyl-2-methyl-phenyl)furan-2-carboxamide CAS Name: 5-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)furan-2-carboxamide Traditional Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(4-hydroxy-5-isopropyl-2-methyl-phenyl)-2-furamide Formula: C21H24BrN3O3 MolecularWeight: 446.33756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)O)C(C)C)NC(=O)C2=CC=C(O2)CN3C(=C(C(=N3)C)Br)C

Isomeric SMILES

CC1=C(C=C(C(=C1)O)C(C)C)NC(=O)C2=CC=C(O2)CN3C(=C(C(=N3)C)Br)C

InChI

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