N-[4-(aminocarbonylamino)phenyl]-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-[4-(aminocarbonylamino)phenyl]-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: 1-(2-fluorophenyl)-5-pyrrol-1-yl-N-(4-ureidophenyl)pyrazole-4-carboxamide CAS Name: N-[4-(carbamoylamino)phenyl]-1-(2-fluorophenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[4-(carbamoylamino)phenyl]-1-(2-fluorophenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: 1-(2-fluorophenyl)-5-pyrrol-1-yl-N-(4-ureidophenyl)pyrazole-4-carboxamide Formula: C21H17FN6O2 MolecularWeight: 404.397083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N2C(=C(C=N2)C(=O)NC3=CC=C(C=C3)NC(=O)N)N4C=CC=C4)F

Isomeric SMILES

C1=CC=C(C(=C1)N2C(=C(C=N2)C(=O)NC3=CC=C(C=C3)NC(=O)N)N4C=CC=C4)F

InChI

InChI=1S/C21H17FN6O2/c22-17-5-1-2-6-18(17)28-20(27-11-3-4-12-27)16(13-24-28)19(29)25-14-7-9-15(10-8-14)26-21(23)30/h1-13H,(H,25,29)(H3,23,26,30)