N-[2,6-bis(bromanyl)-4-nitro-phenyl]-3-bromanyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-nitro-phenyl]-3-bromanyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: 3-bromo-N-(2,6-dibromo-4-nitro-phenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: 3-bromo-N-(2,6-dibromo-4-nitrophenyl)-2-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: 3-bromo-N-(2,6-dibromo-4-nitrophenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: 3-bromo-N-(2,6-dibromo-4-nitro-phenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Formula: C13H6Br3N5O3 MolecularWeight: 519.93044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN2C(=C(C(=N2)C(=O)NC3=C(C=C(C=C3Br)[N+](=O)[O-])Br)Br)N=C1

Isomeric SMILES

C1=CN2C(=C(C(=N2)C(=O)NC3=C(C=C(C=C3Br)[N+](=O)[O-])Br)Br)N=C1

InChI

InChI=1S/C13H6Br3N5O3/c14-7-4-6(21(23)24)5-8(15)10(7)18-13(22)11-9(16)12-17-2-1-3-20(12)19-11/h1-5H,(H,18,22)