4-phenyl-N-[3,5,6-tris[(4-phenylphenyl)carbonylamino]pyrazin-2-yl]benzamide

Systemtic Name: 4-phenyl-N-[3,5,6-tris[(4-phenylphenyl)carbonylamino]pyrazin-2-yl]benzamide Openeye Name: 4-phenyl-N-[3,5,6-tris[(4-phenylbenzoyl)amino]pyrazin-2-yl]benzamide CAS Name: 4-phenyl-N-[3,5,6-tris[[oxo-(4-phenylphenyl)methyl]amino]-2-pyrazinyl]benzamide IUPAC Name: 4-phenyl-N-[3,5,6-tris[(4-phenylbenzoyl)amino]pyrazin-2-yl]benzamide Traditional Name: 4-phenyl-N-[3,5,6-tris[(4-phenylbenzoyl)amino]pyrazin-2-yl]benzamide Formula: C56H40N6O4 MolecularWeight: 860.9546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC3=C(N=C(C(=N3)NC(=O)C4=CC=C(C=C4)C5=CC=CC=C5)NC(=O)C6=CC=C(C=C6)C7=CC=CC=C7)NC(=O)C8=CC=C(C=C8)C9=CC=CC=C9

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC3=C(N=C(C(=N3)NC(=O)C4=CC=C(C=C4)C5=CC=CC=C5)NC(=O)C6=CC=C(C=C6)C7=CC=CC=C7)NC(=O)C8=CC=C(C=C8)C9=CC=CC=C9

InChI

InChI=1S/C56H40N6O4/c63-53(45-29-21-41(22-30-45)37-13-5-1-6-14-37)59-49-50(60-54(64)46-31-23-42(24-32-46)38-15-7-2-8-16-38)58-52(62-56(66)48-35-27-44(28-36-48)40-19-11-4-12-20-40)51(57-49)61-55(65)47-33-25-43(26-34-47)39-17-9-3-10-18-39/h1-36H,(H2,57,59,61,63,65)(H2,58,60,62,64,66)