N-[[(2-bromophenyl)amino]-[(4,6-dimethylpyrimidin-2-yl)amino]methylidene]-2-chloranyl-5-nitro-benzamide

Systemtic Name: N-[[(2-bromophenyl)amino]-[(4,6-dimethylpyrimidin-2-yl)amino]methylidene]-2-chloranyl-5-nitro-benzamide Openeye Name: N-[(2-bromoanilino)-[(4,6-dimethylpyrimidin-2-yl)amino]methylene]-2-chloro-5-nitro-benzamide CAS Name: N-[(2-bromoanilino)-[(4,6-dimethyl-2-pyrimidinyl)amino]methylidene]-2-chloro-5-nitrobenzamide IUPAC Name: N-[(2-bromoanilino)-[(4,6-dimethylpyrimidin-2-yl)amino]methylidene]-2-chloro-5-nitrobenzamide Traditional Name: N-[(2-bromoanilino)-[(4,6-dimethylpyrimidin-2-yl)amino]methylene]-2-chloro-5-nitro-benzamide Formula: C20H16BrClN6O3 MolecularWeight: 503.73644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)NC3=CC=CC=C3Br)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)NC3=CC=CC=C3Br)C

InChI

InChI=1S/C20H16BrClN6O3/c1-11-9-12(2)24-19(23-11)27-20(25-17-6-4-3-5-15(17)21)26-18(29)14-10-13(28(30)31)7-8-16(14)22/h3-10H,1-2H3,(H2,23,24,25,26,27,29)