2-bromanyl-N'-[6-(furan-2-ylmethylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide

Systemtic Name: 2-bromanyl-N'-[6-(furan-2-ylmethylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: 2-bromo-N'-[6-(2-furylmethylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide CAS Name: 2-bromo-N'-[6-(2-furanylmethylamino)-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: 2-bromo-N'-[6-(furan-2-ylmethylamino)-5-nitropyrimidin-4-yl]benzohydrazide Traditional Name: 2-bromo-N'-[6-(2-furfurylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide Formula: C16H13BrN6O4 MolecularWeight: 433.21622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=CO3)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=CO3)Br

InChI

InChI=1S/C16H13BrN6O4/c17-12-6-2-1-5-11(12)16(24)22-21-15-13(23(25)26)14(19-9-20-15)18-8-10-4-3-7-27-10/h1-7,9H,8H2,(H,22,24)(H2,18,19,20,21)