5,15-bis[(4-chlorophenyl)sulfanyl]-10,20-diphenyl-21,22-dihydroporphyrin

Systemtic Name: 5,15-bis[(4-chlorophenyl)sulfanyl]-10,20-diphenyl-21,22-dihydroporphyrin Openeye Name: 5,15-bis[(4-chlorophenyl)sulfanyl]-10,20-diphenyl-21,22-dihydroporphyrin CAS Name: 5,15-bis[(4-chlorophenyl)thio]-10,20-diphenyl-21,22-dihydroporphyrin IUPAC Name: 5,15-bis[(4-chlorophenyl)sulfanyl]-10,20-diphenyl-21,22-dihydroporphyrin Traditional Name: 5,15-bis[(4-chlorophenyl)thio]-10,20-diphenyl-21,22-dihydroporphine Formula: C44H28Cl2N4S2 MolecularWeight: 747.75592

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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)SC7=CC=C(C=C7)Cl)C8=CC=CC=C8)SC9=CC=C(C=C9)Cl)N3

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)SC7=CC=C(C=C7)Cl)C8=CC=CC=C8)SC9=CC=C(C=C9)Cl)N3

InChI

InChI=1S/C44H28Cl2N4S2/c45-29-11-15-31(16-12-29)51-43-37-23-19-33(47-37)41(27-7-3-1-4-8-27)34-20-24-38(48-34)44(52-32-17-13-30(46)14-18-32)40-26-22-36(50-40)42(28-9-5-2-6-10-28)35-21-25-39(43)49-35/h1-26,47,49H