N'-[6-[(2-ethylphenyl)amino]-5-nitro-pyrimidin-4-yl]-4-methyl-benzohydrazide

Systemtic Name: N'-[6-[(2-ethylphenyl)amino]-5-nitro-pyrimidin-4-yl]-4-methyl-benzohydrazide Openeye Name: N'-[6-(2-ethylanilino)-5-nitro-pyrimidin-4-yl]-4-methyl-benzohydrazide CAS Name: N'-[6-(2-ethylanilino)-5-nitro-4-pyrimidinyl]-4-methylbenzohydrazide IUPAC Name: N'-[6-(2-ethylanilino)-5-nitropyrimidin-4-yl]-4-methylbenzohydrazide Traditional Name: N'-[6-(2-ethylanilino)-5-nitro-pyrimidin-4-yl]-4-methyl-benzohydrazide Formula: C20H20N6O3 MolecularWeight: 392.4112

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=C(C(=NC=N2)NNC(=O)C3=CC=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=CC=C1NC2=C(C(=NC=N2)NNC(=O)C3=CC=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H20N6O3/c1-3-14-6-4-5-7-16(14)23-18-17(26(28)29)19(22-12-21-18)24-25-20(27)15-10-8-13(2)9-11-15/h4-12H,3H2,1-2H3,(H,25,27)(H2,21,22,23,24)