4,5-dimethoxy-N-[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl]-2-nitro-benzamide

Systemtic Name: 4,5-dimethoxy-N-[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl]-2-nitro-benzamide Openeye Name: 4,5-dimethoxy-N-[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl]-2-nitro-benzamide CAS Name: 4,5-dimethoxy-N-[4-[(2-methyl-6-phenyl-4-pyrimidinyl)amino]phenyl]-2-nitrobenzamide IUPAC Name: 4,5-dimethoxy-N-[4-[(2-methyl-6-phenylpyrimidin-4-yl)amino]phenyl]-2-nitrobenzamide Traditional Name: 4,5-dimethoxy-N-[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl]-2-nitro-benzamide Formula: C26H23N5O5 MolecularWeight: 485.49132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C4=CC=CC=C4

InChI

InChI=1S/C26H23N5O5/c1-16-27-21(17-7-5-4-6-8-17)14-25(28-16)29-18-9-11-19(12-10-18)30-26(32)20-13-23(35-2)24(36-3)15-22(20)31(33)34/h4-15H,1-3H3,(H,30,32)(H,27,28,29)