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

Systemtic Name: 3-chloranyl-N'-[5-nitro-6-(2-piperidin-1-ylethylamino)pyrimidin-4-yl]benzohydrazide Openeye Name: 3-chloro-N'-[5-nitro-6-[2-(1-piperidyl)ethylamino]pyrimidin-4-yl]benzohydrazide CAS Name: 3-chloro-N'-[5-nitro-6-[2-(1-piperidinyl)ethylamino]-4-pyrimidinyl]benzohydrazide IUPAC Name: 3-chloro-N'-[5-nitro-6-(2-piperidin-1-ylethylamino)pyrimidin-4-yl]benzohydrazide Traditional Name: 3-chloro-N'-[5-nitro-6-(2-piperidinoethylamino)pyrimidin-4-yl]benzohydrazide Formula: C18H22ClN7O3 MolecularWeight: 419.86538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22ClN7O3/c19-14-6-4-5-13(11-14)18(27)24-23-17-15(26(28)29)16(21-12-22-17)20-7-10-25-8-2-1-3-9-25/h4-6,11-12H,1-3,7-10H2,(H,24,27)(H2,20,21,22,23)