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

Systemtic Name: 5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-methylquinolin-4-yl)furan-2-carboxamide Openeye Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-methyl-4-quinolyl)furan-2-carboxamide CAS Name: 5-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-(2-methyl-4-quinolinyl)-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-methylquinolin-4-yl)furan-2-carboxamide Traditional Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-methyl-4-quinolyl)-2-furamide Formula: C21H19BrN4O2 MolecularWeight: 439.30516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C3=CC=C(O3)CN4C(=C(C(=N4)C)Br)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C3=CC=C(O3)CN4C(=C(C(=N4)C)Br)C

InChI

InChI=1S/C21H19BrN4O2/c1-12-10-18(16-6-4-5-7-17(16)23-12)24-21(27)19-9-8-15(28-19)11-26-14(3)20(22)13(2)25-26/h4-10H,11H2,1-3H3,(H,23,24,27)