N-(3-aminocarbonyl-4-chloranyl-phenyl)-1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-(3-aminocarbonyl-4-chloranyl-phenyl)-1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-(3-carbamoyl-4-chloro-phenyl)-1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-(3-carbamoyl-4-chlorophenyl)-1-(4-fluorophenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-(3-carbamoyl-4-chlorophenyl)-1-(4-fluorophenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-(3-carbamoyl-4-chloro-phenyl)-1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C21H15ClFN5O2 MolecularWeight: 423.827503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=C(C=NN2C3=CC=C(C=C3)F)C(=O)NC4=CC(=C(C=C4)Cl)C(=O)N

Isomeric SMILES

C1=CN(C=C1)C2=C(C=NN2C3=CC=C(C=C3)F)C(=O)NC4=CC(=C(C=C4)Cl)C(=O)N

InChI

InChI=1S/C21H15ClFN5O2/c22-18-8-5-14(11-16(18)19(24)29)26-20(30)17-12-25-28(15-6-3-13(23)4-7-15)21(17)27-9-1-2-10-27/h1-12H,(H2,24,29)(H,26,30)