N'-[6-[(2,3-dimethylphenyl)amino]-5-nitro-pyrimidin-4-yl]-4-fluoranyl-benzohydrazide

Systemtic Name: N'-[6-[(2,3-dimethylphenyl)amino]-5-nitro-pyrimidin-4-yl]-4-fluoranyl-benzohydrazide Openeye Name: N'-[6-(2,3-dimethylanilino)-5-nitro-pyrimidin-4-yl]-4-fluoro-benzohydrazide CAS Name: N'-[6-(2,3-dimethylanilino)-5-nitro-4-pyrimidinyl]-4-fluorobenzohydrazide IUPAC Name: N'-[6-(2,3-dimethylanilino)-5-nitropyrimidin-4-yl]-4-fluorobenzohydrazide Traditional Name: N'-[6-(2,3-dimethylanilino)-5-nitro-pyrimidin-4-yl]-4-fluoro-benzohydrazide Formula: C19H17FN6O3 MolecularWeight: 396.375083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=C(C=C3)F)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=C(C=C3)F)[N+](=O)[O-])C

InChI

InChI=1S/C19H17FN6O3/c1-11-4-3-5-15(12(11)2)23-17-16(26(28)29)18(22-10-21-17)24-25-19(27)13-6-8-14(20)9-7-13/h3-10H,1-2H3,(H,25,27)(H2,21,22,23,24)