N-(1,3-benzodioxol-5-ylmethyl)-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(2-fluorophenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(2-fluorophenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: 1-(2-fluorophenyl)-N-piperonyl-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C22H17FN4O3 MolecularWeight: 404.393783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(N(N=C3)C4=CC=CC=C4F)N5C=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(N(N=C3)C4=CC=CC=C4F)N5C=CC=C5

InChI

InChI=1S/C22H17FN4O3/c23-17-5-1-2-6-18(17)27-22(26-9-3-4-10-26)16(13-25-27)21(28)24-12-15-7-8-19-20(11-15)30-14-29-19/h1-11,13H,12,14H2,(H,24,28)