2-bromanyl-N'-[6-[2-(cyclohexen-1-yl)ethylamino]-5-nitro-pyrimidin-4-yl]benzohydrazide

Systemtic Name: 2-bromanyl-N'-[6-[2-(cyclohexen-1-yl)ethylamino]-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: 2-bromo-N'-[6-[2-(cyclohexen-1-yl)ethylamino]-5-nitro-pyrimidin-4-yl]benzohydrazide CAS Name: 2-bromo-N'-[6-[2-(1-cyclohexenyl)ethylamino]-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: 2-bromo-N'-[6-[2-(cyclohexen-1-yl)ethylamino]-5-nitropyrimidin-4-yl]benzohydrazide Traditional Name: 2-bromo-N'-[6-[2-(cyclohexen-1-yl)ethylamino]-5-nitro-pyrimidin-4-yl]benzohydrazide Formula: C19H21BrN6O3 MolecularWeight: 461.31244

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC2=C(C(=NC=N2)NNC(=O)C3=CC=CC=C3Br)[N+](=O)[O-]

Isomeric SMILES

C1CCC(=CC1)CCNC2=C(C(=NC=N2)NNC(=O)C3=CC=CC=C3Br)[N+](=O)[O-]

InChI

InChI=1S/C19H21BrN6O3/c20-15-9-5-4-8-14(15)19(27)25-24-18-16(26(28)29)17(22-12-23-18)21-11-10-13-6-2-1-3-7-13/h4-6,8-9,12H,1-3,7,10-11H2,(H,25,27)(H2,21,22,23,24)