N-(4-bromanyl-3-methyl-phenyl)-1-(4-fluorophenyl)-4-propoxy-pyrazole-3-carboxamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-1-(4-fluorophenyl)-4-propoxy-pyrazole-3-carboxamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-1-(4-fluorophenyl)-4-propoxy-pyrazole-3-carboxamide CAS Name: N-(4-bromo-3-methylphenyl)-1-(4-fluorophenyl)-4-propoxy-3-pyrazolecarboxamide IUPAC Name: N-(4-bromo-3-methylphenyl)-1-(4-fluorophenyl)-4-propoxypyrazole-3-carboxamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-1-(4-fluorophenyl)-4-propoxy-pyrazole-3-carboxamide Formula: C20H19BrFN3O2 MolecularWeight: 432.286163

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CN(N=C1C(=O)NC2=CC(=C(C=C2)Br)C)C3=CC=C(C=C3)F

Isomeric SMILES

CCCOC1=CN(N=C1C(=O)NC2=CC(=C(C=C2)Br)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H19BrFN3O2/c1-3-10-27-18-12-25(16-7-4-14(22)5-8-16)24-19(18)20(26)23-15-6-9-17(21)13(2)11-15/h4-9,11-12H,3,10H2,1-2H3,(H,23,26)