7-(5-bromanyl-2-fluoranyl-phenyl)-5-methyl-N3,N6-diphenyl-1,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide

Systemtic Name: 7-(5-bromanyl-2-fluoranyl-phenyl)-5-methyl-N3,N6-diphenyl-1,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide Openeye Name: 7-(5-bromo-2-fluoro-phenyl)-5-methyl-N3,N6-diphenyl-1,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide CAS Name: 7-(5-bromo-2-fluorophenyl)-5-methyl-N3,N6-diphenyl-1,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide IUPAC Name: 7-(5-bromo-2-fluorophenyl)-5-methyl-3-N,6-N-diphenyl-1,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide Traditional Name: 7-(5-bromo-2-fluoro-phenyl)-5-methyl-N,N'-diphenyl-1,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide Formula: C27H21BrFN5O2 MolecularWeight: 546.390343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N2C(=N1)C(=CN2)C(=O)NC3=CC=CC=C3)C4=C(C=CC(=C4)Br)F)C(=O)NC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(N2C(=N1)C(=CN2)C(=O)NC3=CC=CC=C3)C4=C(C=CC(=C4)Br)F)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C27H21BrFN5O2/c1-16-23(27(36)33-19-10-6-3-7-11-19)24(20-14-17(28)12-13-22(20)29)34-25(31-16)21(15-30-34)26(35)32-18-8-4-2-5-9-18/h2-15,24,30H,1H3,(H,32,35)(H,33,36)