copper 5,10,15,20-tetrathiophen-2-ylporphyrin-22,23-diide

Systemtic Name: copper 5,10,15,20-tetrathiophen-2-ylporphyrin-22,23-diide Openeye Name: copper 5,10,15,20-tetrakis(2-thienyl)porphyrin-22,23-diide CAS Name: copper 5,10,15,20-tetrathiophen-2-ylporphyrin-22,23-diide IUPAC Name: copper 5,10,15,20-tetrathiophen-2-ylporphyrin-22,23-diide Traditional Name: cupric 5,10,15,20-tetrakis(2-thienyl)porphine-22,23-diide Formula: C36H20CuN4S4 MolecularWeight: 700.3768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=C3C=CC(=C(C4=CC=C([N-]4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=CS7)C8=CC=CS8)C9=CC=CS9)[N-]3.[Cu+2]

Isomeric SMILES

C1=CSC(=C1)C2=C3C=CC(=C(C4=CC=C([N-]4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=CS7)C8=CC=CS8)C9=CC=CS9)[N-]3.[Cu+2]

InChI

InChI=1S/C36H20N4S4.Cu/c1-5-29(41-17-1)33-21-9-11-23(37-21)34(30-6-2-18-42-30)25-13-15-27(39-25)36(32-8-4-20-44-32)28-16-14-26(40-28)35(31-7-3-19-43-31)24-12-10-22(33)38-24;/h1-20H;/q-2;+2