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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-ethylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-ethylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-ethylphenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-ethylphenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: 1-(4-ethylphenyl)-N-piperonyl-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C24H22N4O3 MolecularWeight: 414.45648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCC3=CC4=C(C=C3)OCO4)N5C=CC=C5

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCC3=CC4=C(C=C3)OCO4)N5C=CC=C5

InChI

InChI=1S/C24H22N4O3/c1-2-17-5-8-19(9-6-17)28-24(27-11-3-4-12-27)20(15-26-28)23(29)25-14-18-7-10-21-22(13-18)31-16-30-21/h3-13,15H,2,14,16H2,1H3,(H,25,29)