N-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-4-[(3-fluoranylphenoxy)methyl]thiophene-2-carboxamide

Systemtic Name: N-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-4-[(3-fluoranylphenoxy)methyl]thiophene-2-carboxamide Openeye Name: N-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-4-[(3-fluorophenoxy)methyl]thiophene-2-carboxamide CAS Name: N-[1-[(4-bromophenyl)methyl]-3-pyrazolyl]-4-[(3-fluorophenoxy)methyl]-2-thiophenecarboxamide IUPAC Name: N-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-4-[(3-fluorophenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-[1-(4-bromobenzyl)pyrazol-3-yl]-4-[(3-fluorophenoxy)methyl]thiophene-2-carboxamide Formula: C22H17BrFN3O2S MolecularWeight: 486.356683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)OCC2=CSC(=C2)C(=O)NC3=NN(C=C3)CC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC(=CC(=C1)F)OCC2=CSC(=C2)C(=O)NC3=NN(C=C3)CC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H17BrFN3O2S/c23-17-6-4-15(5-7-17)12-27-9-8-21(26-27)25-22(28)20-10-16(14-30-20)13-29-19-3-1-2-18(24)11-19/h1-11,14H,12-13H2,(H,25,26,28)