N-(4-bromanyl-2-fluoranyl-phenyl)-3-(4-methoxyphenyl)-7-methyl-5-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-2-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-3-(4-methoxyphenyl)-7-methyl-5-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-3-(4-methoxyphenyl)-7-methyl-5-oxo-1H-pyrazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-3-(4-methoxyphenyl)-7-methyl-5-oxo-1H-pyrazolo[1,5-a]pyrimidine-2-carboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-3-(4-methoxyphenyl)-7-methyl-5-oxo-1H-pyrazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-5-keto-3-(4-methoxyphenyl)-7-methyl-1H-pyrazolo[1,5-a]pyrimidine-2-carboxamide Formula: C21H16BrFN4O3 MolecularWeight: 471.279143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C2N1NC(=C2C3=CC=C(C=C3)OC)C(=O)NC4=C(C=C(C=C4)Br)F

Isomeric SMILES

CC1=CC(=O)N=C2N1NC(=C2C3=CC=C(C=C3)OC)C(=O)NC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C21H16BrFN4O3/c1-11-9-17(28)25-20-18(12-3-6-14(30-2)7-4-12)19(26-27(11)20)21(29)24-16-8-5-13(22)10-15(16)23/h3-10,26H,1-2H3,(H,24,29)