5-(10,15,20-triphenyl-23,24-dihydroporphyrin-5-yl)-1H-pyrimidine-2,4-dione

Systemtic Name: 5-(10,15,20-triphenyl-23,24-dihydroporphyrin-5-yl)-1H-pyrimidine-2,4-dione Openeye Name: 5-(10,15,20-triphenyl-23,24-dihydroporphyrin-5-yl)-1H-pyrimidine-2,4-dione CAS Name: 5-(10,15,20-triphenyl-23,24-dihydroporphyrin-5-yl)-1H-pyrimidine-2,4-dione IUPAC Name: 5-(10,15,20-triphenyl-23,24-dihydroporphyrin-5-yl)-1H-pyrimidine-2,4-dione Traditional Name: 5-(10,15,20-triphenyl-23,24-dihydroporphin-5-yl)uracil Formula: C42H28N6O2 MolecularWeight: 648.71072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CNC(=O)NC7=O)C8=CC=CC=C8)C9=CC=CC=C9)N3

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CNC(=O)NC7=O)C8=CC=CC=C8)C9=CC=CC=C9)N3

InChI

InChI=1S/C42H28N6O2/c49-41-28(24-43-42(50)48-41)40-35-22-20-33(46-35)38(26-12-6-2-7-13-26)31-18-16-29(44-31)37(25-10-4-1-5-11-25)30-17-19-32(45-30)39(27-14-8-3-9-15-27)34-21-23-36(40)47-34/h1-24,44-45H,(H2,43,48,49,50)