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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-fluorophenyl)-3-methyl-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: 1-(4-fluorophenyl)-3-methyl-N-piperonyl-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C23H19FN4O3 MolecularWeight: 418.420363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCC2=CC3=C(C=C2)OCO3)N4C=CC=C4)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCC2=CC3=C(C=C2)OCO3)N4C=CC=C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C23H19FN4O3/c1-15-21(22(29)25-13-16-4-9-19-20(12-16)31-14-30-19)23(27-10-2-3-11-27)28(26-15)18-7-5-17(24)6-8-18/h2-12H,13-14H2,1H3,(H,25,29)