N-(4-aminocarbonylphenyl)-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-(4-aminocarbonylphenyl)-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-(4-carbamoylphenyl)-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-(4-carbamoylphenyl)-1-(2-fluorophenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-(4-carbamoylphenyl)-1-(2-fluorophenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-(4-carbamoylphenyl)-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C21H16FN5O2 MolecularWeight: 389.382443

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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)C(=O)N)N4C=CC=C4)F

Isomeric SMILES

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

InChI

InChI=1S/C21H16FN5O2/c22-17-5-1-2-6-18(17)27-21(26-11-3-4-12-26)16(13-24-27)20(29)25-15-9-7-14(8-10-15)19(23)28/h1-13H,(H2,23,28)(H,25,29)