4-morpholin-4-yl-3-nitro-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]benzamide

Systemtic Name: 4-morpholin-4-yl-3-nitro-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]benzamide Openeye Name: 4-morpholino-3-nitro-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]benzamide CAS Name: 4-(4-morpholinyl)-3-nitro-N-[4-[(6-phenyl-4-pyrimidinyl)amino]phenyl]benzamide IUPAC Name: 4-morpholin-4-yl-3-nitro-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]benzamide Traditional Name: 4-morpholino-3-nitro-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]benzamide Formula: C27H24N6O4 MolecularWeight: 496.51726

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)NC4=NC=NC(=C4)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)NC4=NC=NC(=C4)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H24N6O4/c34-27(20-6-11-24(25(16-20)33(35)36)32-12-14-37-15-13-32)31-22-9-7-21(8-10-22)30-26-17-23(28-18-29-26)19-4-2-1-3-5-19/h1-11,16-18H,12-15H2,(H,31,34)(H,28,29,30)