4-fluoranyl-N'-[5-nitro-6-[(phenylmethyl)-pyridin-2-yl-amino]pyrimidin-4-yl]benzohydrazide

Systemtic Name: 4-fluoranyl-N'-[5-nitro-6-[(phenylmethyl)-pyridin-2-yl-amino]pyrimidin-4-yl]benzohydrazide Openeye Name: N'-[6-[benzyl(2-pyridyl)amino]-5-nitro-pyrimidin-4-yl]-4-fluoro-benzohydrazide CAS Name: 4-fluoro-N'-[5-nitro-6-[(phenylmethyl)-(2-pyridinyl)amino]-4-pyrimidinyl]benzohydrazide IUPAC Name: N'-[6-[benzyl(pyridin-2-yl)amino]-5-nitropyrimidin-4-yl]-4-fluorobenzohydrazide Traditional Name: N'-[6-[benzyl(2-pyridyl)amino]-5-nitro-pyrimidin-4-yl]-4-fluoro-benzohydrazide Formula: C23H18FN7O3 MolecularWeight: 459.432523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC=CC=N2)C3=NC=NC(=C3[N+](=O)[O-])NNC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC=CC=N2)C3=NC=NC(=C3[N+](=O)[O-])NNC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H18FN7O3/c24-18-11-9-17(10-12-18)23(32)29-28-21-20(31(33)34)22(27-15-26-21)30(19-8-4-5-13-25-19)14-16-6-2-1-3-7-16/h1-13,15H,14H2,(H,29,32)(H,26,27,28)