2-methylpropyl 4-[[5-nitro-6-[2-(2-phenylethanoyl)hydrazinyl]pyrimidin-4-yl]amino]benzoate

Systemtic Name: 2-methylpropyl 4-[[5-nitro-6-[2-(2-phenylethanoyl)hydrazinyl]pyrimidin-4-yl]amino]benzoate Openeye Name: isobutyl 4-[[5-nitro-6-[2-(2-phenylacetyl)hydrazino]pyrimidin-4-yl]amino]benzoate CAS Name: 4-[[5-nitro-6-[(1-oxo-2-phenylethyl)hydrazo]-4-pyrimidinyl]amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[[5-nitro-6-[2-(2-phenylacetyl)hydrazinyl]pyrimidin-4-yl]amino]benzoate Traditional Name: 4-[[5-nitro-6-[N'-(2-phenylacetyl)hydrazino]pyrimidin-4-yl]amino]benzoic acid isobutyl ester Formula: C23H24N6O5 MolecularWeight: 464.47386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)NNC(=O)CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)COC(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)NNC(=O)CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H24N6O5/c1-15(2)13-34-23(31)17-8-10-18(11-9-17)26-21-20(29(32)33)22(25-14-24-21)28-27-19(30)12-16-6-4-3-5-7-16/h3-11,14-15H,12-13H2,1-2H3,(H,27,30)(H2,24,25,26,28)