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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CC3=C(C=C2)OCO3)N4C=CC=C4)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CC3=C(C=C2)OCO3)N4C=CC=C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C22H17FN4O3/c1-14-20(21(28)24-16-6-9-18-19(12-16)30-13-29-18)22(26-10-2-3-11-26)27(25-14)17-7-4-15(23)5-8-17/h2-12H,13H2,1H3,(H,24,28)