4-bromanyl-N'-[5-nitro-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidin-4-yl]benzohydrazide

Systemtic Name: 4-bromanyl-N'-[5-nitro-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidin-4-yl]benzohydrazide Openeye Name: N'-[6-(4-benzyl-1-piperidyl)-5-nitro-pyrimidin-4-yl]-4-bromo-benzohydrazide CAS Name: 4-bromo-N'-[5-nitro-6-[4-(phenylmethyl)-1-piperidinyl]-4-pyrimidinyl]benzohydrazide IUPAC Name: N'-[6-(4-benzylpiperidin-1-yl)-5-nitropyrimidin-4-yl]-4-bromobenzohydrazide Traditional Name: N'-[6-(4-benzylpiperidino)-5-nitro-pyrimidin-4-yl]-4-bromo-benzohydrazide Formula: C23H23BrN6O3 MolecularWeight: 511.37112

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=C(C(=NC=N3)NNC(=O)C4=CC=C(C=C4)Br)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=C(C(=NC=N3)NNC(=O)C4=CC=C(C=C4)Br)[N+](=O)[O-]

InChI

InChI=1S/C23H23BrN6O3/c24-19-8-6-18(7-9-19)23(31)28-27-21-20(30(32)33)22(26-15-25-21)29-12-10-17(11-13-29)14-16-4-2-1-3-5-16/h1-9,15,17H,10-14H2,(H,28,31)(H,25,26,27)