2-fluoranyl-N'-[5-nitro-6-(2-piperidin-1-ylethylamino)pyrimidin-4-yl]benzohydrazide

Systemtic Name: 2-fluoranyl-N'-[5-nitro-6-(2-piperidin-1-ylethylamino)pyrimidin-4-yl]benzohydrazide Openeye Name: 2-fluoro-N'-[5-nitro-6-[2-(1-piperidyl)ethylamino]pyrimidin-4-yl]benzohydrazide CAS Name: 2-fluoro-N'-[5-nitro-6-[2-(1-piperidinyl)ethylamino]-4-pyrimidinyl]benzohydrazide IUPAC Name: 2-fluoro-N'-[5-nitro-6-(2-piperidin-1-ylethylamino)pyrimidin-4-yl]benzohydrazide Traditional Name: 2-fluoro-N'-[5-nitro-6-(2-piperidinoethylamino)pyrimidin-4-yl]benzohydrazide Formula: C18H22FN7O3 MolecularWeight: 403.410783

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNC2=C(C(=NC=N2)NNC(=O)C3=CC=CC=C3F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CCNC2=C(C(=NC=N2)NNC(=O)C3=CC=CC=C3F)[N+](=O)[O-]

InChI

InChI=1S/C18H22FN7O3/c19-14-7-3-2-6-13(14)18(27)24-23-17-15(26(28)29)16(21-12-22-17)20-8-11-25-9-4-1-5-10-25/h2-3,6-7,12H,1,4-5,8-11H2,(H,24,27)(H2,20,21,22,23)