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

Systemtic Name: 2-bromanyl-N'-[6-(cyclohexylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: 2-bromo-N'-[6-(cyclohexylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide CAS Name: 2-bromo-N'-[6-(cyclohexylamino)-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: 2-bromo-N'-[6-(cyclohexylamino)-5-nitropyrimidin-4-yl]benzohydrazide Traditional Name: 2-bromo-N'-[6-(cyclohexylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide Formula: C17H19BrN6O3 MolecularWeight: 435.27516

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=CC=C3Br)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=CC=C3Br)[N+](=O)[O-]

InChI

InChI=1S/C17H19BrN6O3/c18-13-9-5-4-8-12(13)17(25)23-22-16-14(24(26)27)15(19-10-20-16)21-11-6-2-1-3-7-11/h4-5,8-11H,1-3,6-7H2,(H,23,25)(H2,19,20,21,22)