4-[4-(2-chloranyl-3-fluoranyl-phenyl)-5-oxidanylidene-pyrazol-3-yl]-N-(cyclopentylmethyl)-1H-pyrrole-2-carboxamide

Systemtic Name: 4-[4-(2-chloranyl-3-fluoranyl-phenyl)-5-oxidanylidene-pyrazol-3-yl]-N-(cyclopentylmethyl)-1H-pyrrole-2-carboxamide Openeye Name: 4-[4-(2-chloro-3-fluoro-phenyl)-5-oxo-pyrazol-3-yl]-N-(cyclopentylmethyl)-1H-pyrrole-2-carboxamide CAS Name: 4-[4-(2-chloro-3-fluorophenyl)-5-oxo-3-pyrazolyl]-N-(cyclopentylmethyl)-1H-pyrrole-2-carboxamide IUPAC Name: 4-[4-(2-chloro-3-fluorophenyl)-5-oxopyrazol-3-yl]-N-(cyclopentylmethyl)-1H-pyrrole-2-carboxamide Traditional Name: 4-[4-(2-chloro-3-fluoro-phenyl)-5-keto-pyrazol-3-yl]-N-(cyclopentylmethyl)-1H-pyrrole-2-carboxamide Formula: C20H18ClFN4O2 MolecularWeight: 400.833923

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CNC(=O)C2=CC(=CN2)C3=C(C(=O)N=N3)C4=C(C(=CC=C4)F)Cl

Isomeric SMILES

C1CCC(C1)CNC(=O)C2=CC(=CN2)C3=C(C(=O)N=N3)C4=C(C(=CC=C4)F)Cl

InChI

InChI=1S/C20H18ClFN4O2/c21-17-13(6-3-7-14(17)22)16-18(25-26-20(16)28)12-8-15(23-10-12)19(27)24-9-11-4-1-2-5-11/h3,6-8,10-11,23H,1-2,4-5,9H2,(H,24,27)