5-(3-chloranyl-4-fluoranyl-phenyl)-7-oxidanylidene-N-(phenylmethyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

Systemtic Name: 5-(3-chloranyl-4-fluoranyl-phenyl)-7-oxidanylidene-N-(phenylmethyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: N-benzyl-5-(3-chloro-4-fluoro-phenyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: 5-(3-chloro-4-fluorophenyl)-7-oxo-N-(phenylmethyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide IUPAC Name: N-benzyl-5-(3-chloro-4-fluorophenyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: N-benzyl-5-(3-chloro-4-fluoro-phenyl)-7-keto-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C20H14ClFN4O2 MolecularWeight: 396.802163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CNN3C2=NC(=CC3=O)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CNN3C2=NC(=CC3=O)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C20H14ClFN4O2/c21-15-8-13(6-7-16(15)22)17-9-18(27)26-19(25-17)14(11-24-26)20(28)23-10-12-4-2-1-3-5-12/h1-9,11,24H,10H2,(H,23,28)