N-[(4-bromanyl-2-ethyl-pyrazol-3-yl)methyl]-4-[(4-fluoranylphenoxy)methyl]thiophene-2-carboxamide

Systemtic Name: N-[(4-bromanyl-2-ethyl-pyrazol-3-yl)methyl]-4-[(4-fluoranylphenoxy)methyl]thiophene-2-carboxamide Openeye Name: N-[(4-bromo-2-ethyl-pyrazol-3-yl)methyl]-4-[(4-fluorophenoxy)methyl]thiophene-2-carboxamide CAS Name: N-[(4-bromo-2-ethyl-3-pyrazolyl)methyl]-4-[(4-fluorophenoxy)methyl]-2-thiophenecarboxamide IUPAC Name: N-[(4-bromo-2-ethylpyrazol-3-yl)methyl]-4-[(4-fluorophenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-[(4-bromo-2-ethyl-pyrazol-3-yl)methyl]-4-[(4-fluorophenoxy)methyl]thiophene-2-carboxamide Formula: C18H17BrFN3O2S MolecularWeight: 438.313883

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Br)CNC(=O)C2=CC(=CS2)COC3=CC=C(C=C3)F

Isomeric SMILES

CCN1C(=C(C=N1)Br)CNC(=O)C2=CC(=CS2)COC3=CC=C(C=C3)F

InChI

InChI=1S/C18H17BrFN3O2S/c1-2-23-16(15(19)8-22-23)9-21-18(24)17-7-12(11-26-17)10-25-14-5-3-13(20)4-6-14/h3-8,11H,2,9-10H2,1H3,(H,21,24)