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

Systemtic Name: 5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-methylsulfanylphenyl)furan-2-carboxamide Openeye Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-methylsulfanylphenyl)furan-2-carboxamide CAS Name: 5-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-[2-(methylthio)phenyl]-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-methylsulfanylphenyl)furan-2-carboxamide Traditional Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[2-(methylthio)phenyl]-2-furamide Formula: C18H18BrN3O2S MolecularWeight: 420.32342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NC3=CC=CC=C3SC)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NC3=CC=CC=C3SC)C)Br

InChI

InChI=1S/C18H18BrN3O2S/c1-11-17(19)12(2)22(21-11)10-13-8-9-15(24-13)18(23)20-14-6-4-5-7-16(14)25-3/h4-9H,10H2,1-3H3,(H,20,23)