15-(1,3-dithian-2-yl)-5,10,20-triphenyl-21,22-dihydroporphyrin

Systemtic Name: 15-(1,3-dithian-2-yl)-5,10,20-triphenyl-21,22-dihydroporphyrin Openeye Name: 15-(1,3-dithian-2-yl)-5,10,20-triphenyl-21,22-dihydroporphyrin CAS Name: 15-(1,3-dithian-2-yl)-5,10,20-triphenyl-21,22-dihydroporphyrin IUPAC Name: 15-(1,3-dithian-2-yl)-5,10,20-triphenyl-21,22-dihydroporphyrin Traditional Name: 15-(1,3-dithian-2-yl)-5,10,20-triphenyl-21,22-dihydroporphine Formula: C42H32N4S2 MolecularWeight: 656.86028

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)N4)C9=CC=CC=C9

Isomeric SMILES

C1CSC(SC1)C2=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)N4)C9=CC=CC=C9

InChI

InChI=1S/C42H32N4S2/c1-4-11-27(12-5-1)38-30-17-19-32(43-30)39(28-13-6-2-7-14-28)34-21-23-36(45-34)41(42-47-25-10-26-48-42)37-24-22-35(46-37)40(29-15-8-3-9-16-29)33-20-18-31(38)44-33/h1-9,11-24,42-44H,10,25-26H2