3-bromanyl-N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide

Systemtic Name: 3-bromanyl-N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: 3-bromo-N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: 3-bromo-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-2-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: 3-bromo-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: 3-bromo-N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide Formula: C20H13BrClN5O4 MolecularWeight: 502.70532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN4C=CC=NC4=C3Br)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN4C=CC=NC4=C3Br)Cl

InChI

InChI=1S/C20H13BrClN5O4/c1-11-7-14(3-4-16(11)22)31-15-9-12(8-13(10-15)27(29)30)24-20(28)18-17(21)19-23-5-2-6-26(19)25-18/h2-10H,1H3,(H,24,28)