N'-[6-(hexadecylamino)-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide

Systemtic Name: N'-[6-(hexadecylamino)-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide Openeye Name: N'-[6-(hexadecylamino)-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide CAS Name: N'-[6-(hexadecylamino)-5-nitro-4-pyrimidinyl]-2-furancarbohydrazide IUPAC Name: N'-[6-(hexadecylamino)-5-nitropyrimidin-4-yl]furan-2-carbohydrazide Traditional Name: N'-[6-(cetylamino)-5-nitro-pyrimidin-4-yl]-2-furohydrazide Formula: C25H40N6O4 MolecularWeight: 488.6229

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=C(C(=NC=N1)NNC(=O)C2=CC=CO2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=C(C(=NC=N1)NNC(=O)C2=CC=CO2)[N+](=O)[O-]

InChI

InChI=1S/C25H40N6O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-26-23-22(31(33)34)24(28-20-27-23)29-30-25(32)21-17-16-19-35-21/h16-17,19-20H,2-15,18H2,1H3,(H,30,32)(H2,26,27,28,29)