N'-[6-[ethyl-(3-methylphenyl)amino]-5-nitro-pyrimidin-4-yl]-2-phenoxy-ethanehydrazide

Systemtic Name: N'-[6-[ethyl-(3-methylphenyl)amino]-5-nitro-pyrimidin-4-yl]-2-phenoxy-ethanehydrazide Openeye Name: N'-[6-(N-ethyl-3-methyl-anilino)-5-nitro-pyrimidin-4-yl]-2-phenoxy-acetohydrazide CAS Name: N'-[6-(N-ethyl-3-methylanilino)-5-nitro-4-pyrimidinyl]-2-phenoxyacetohydrazide IUPAC Name: N'-[6-(N-ethyl-3-methylanilino)-5-nitropyrimidin-4-yl]-2-phenoxyacetohydrazide Traditional Name: N'-[6-(N-ethyl-3-methyl-anilino)-5-nitro-pyrimidin-4-yl]-2-phenoxy-acetohydrazide Formula: C21H22N6O4 MolecularWeight: 422.43718

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C2=NC=NC(=C2[N+](=O)[O-])NNC(=O)COC3=CC=CC=C3

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C2=NC=NC(=C2[N+](=O)[O-])NNC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C21H22N6O4/c1-3-26(16-9-7-8-15(2)12-16)21-19(27(29)30)20(22-14-23-21)25-24-18(28)13-31-17-10-5-4-6-11-17/h4-12,14H,3,13H2,1-2H3,(H,24,28)(H,22,23,25)