N-[[(4,6-dimethylpyrimidin-2-yl)amino]-[(4-fluoranyl-3-nitro-phenyl)amino]methylidene]-4-methoxy-benzamide

Systemtic Name: N-[[(4,6-dimethylpyrimidin-2-yl)amino]-[(4-fluoranyl-3-nitro-phenyl)amino]methylidene]-4-methoxy-benzamide Openeye Name: N-[[(4,6-dimethylpyrimidin-2-yl)amino]-(4-fluoro-3-nitro-anilino)methylene]-4-methoxy-benzamide CAS Name: N-[[(4,6-dimethyl-2-pyrimidinyl)amino]-(4-fluoro-3-nitroanilino)methylidene]-4-methoxybenzamide IUPAC Name: N-[[(4,6-dimethylpyrimidin-2-yl)amino]-(4-fluoro-3-nitroanilino)methylidene]-4-methoxybenzamide Traditional Name: N-[[(4,6-dimethylpyrimidin-2-yl)amino]-(4-fluoro-3-nitro-anilino)methylene]-4-methoxy-benzamide Formula: C21H19FN6O4 MolecularWeight: 438.411763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=NC(=O)C2=CC=C(C=C2)OC)NC3=CC(=C(C=C3)F)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=NC(=O)C2=CC=C(C=C2)OC)NC3=CC(=C(C=C3)F)[N+](=O)[O-])C

InChI

InChI=1S/C21H19FN6O4/c1-12-10-13(2)24-20(23-12)27-21(25-15-6-9-17(22)18(11-15)28(30)31)26-19(29)14-4-7-16(32-3)8-5-14/h4-11H,1-3H3,(H2,23,24,25,26,27,29)