N-(4-bromanyl-2-fluoranyl-phenyl)-3-propoxy-1-propyl-pyrazole-4-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-3-propoxy-1-propyl-pyrazole-4-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-3-propoxy-1-propyl-pyrazole-4-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-3-propoxy-1-propyl-4-pyrazolecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-3-propoxy-1-propylpyrazole-4-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-3-propoxy-1-propyl-pyrazole-4-carboxamide Formula: C16H19BrFN3O2 MolecularWeight: 384.243363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C(=N1)OCCC)C(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CCCN1C=C(C(=N1)OCCC)C(=O)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C16H19BrFN3O2/c1-3-7-21-10-12(16(20-21)23-8-4-2)15(22)19-14-6-5-11(17)9-13(14)18/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,19,22)