zinc 5-phenyl-10,15,20-trithiophen-2-yl-porphyrin-23,24-diide

Systemtic Name: zinc 5-phenyl-10,15,20-trithiophen-2-yl-porphyrin-23,24-diide Openeye Name: zinc 5-phenyl-10,15,20-tris(2-thienyl)porphyrin-23,24-diide CAS Name: zinc 5-phenyl-10,15,20-trithiophen-2-ylporphyrin-23,24-diide IUPAC Name: zinc 5-phenyl-10,15,20-trithiophen-2-ylporphyrin-23,24-diide Traditional Name: zinc 5-phenyl-10,15,20-tris(2-thienyl)porphine-23,24-diide Formula: C38H22N4S3Zn MolecularWeight: 696.21208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=CS7)C8=CC=CS8)[N-]4)C9=CC=CS9.[Zn+2]

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=CS7)C8=CC=CS8)[N-]4)C9=CC=CS9.[Zn+2]

InChI

InChI=1S/C38H22N4S3.Zn/c1-2-7-23(8-3-1)35-24-12-14-26(39-24)36(32-9-4-20-43-32)28-16-18-30(41-28)38(34-11-6-22-45-34)31-19-17-29(42-31)37(33-10-5-21-44-33)27-15-13-25(35)40-27;/h1-22H;/q-2;+2