4-chloranyl-N'-[6-[ethyl-(3-methylphenyl)amino]-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide

Systemtic Name: 4-chloranyl-N'-[6-[ethyl-(3-methylphenyl)amino]-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Openeye Name: 4-chloro-N'-[6-(N-ethyl-3-methyl-anilino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide CAS Name: 4-chloro-N'-[6-(N-ethyl-3-methylanilino)-5-nitro-4-pyrimidinyl]-3-nitrobenzohydrazide IUPAC Name: 4-chloro-N'-[6-(N-ethyl-3-methylanilino)-5-nitropyrimidin-4-yl]-3-nitrobenzohydrazide Traditional Name: 4-chloro-N'-[6-(N-ethyl-3-methyl-anilino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Formula: C20H18ClN7O5 MolecularWeight: 471.85382

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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)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H18ClN7O5/c1-3-26(14-6-4-5-12(2)9-14)19-17(28(32)33)18(22-11-23-19)24-25-20(29)13-7-8-15(21)16(10-13)27(30)31/h4-11H,3H2,1-2H3,(H,25,29)(H,22,23,24)