10,20-diphenyl-5,15-bis(propylsulfanyl)-21,22-dihydroporphyrin

Systemtic Name: 10,20-diphenyl-5,15-bis(propylsulfanyl)-21,22-dihydroporphyrin Openeye Name: 10,20-diphenyl-5,15-bis(propylsulfanyl)-21,22-dihydroporphyrin CAS Name: 10,20-diphenyl-5,15-bis(propylthio)-21,22-dihydroporphyrin IUPAC Name: 10,20-diphenyl-5,15-bis(propylsulfanyl)-21,22-dihydroporphyrin Traditional Name: 10,20-diphenyl-5,15-bis(propylthio)-21,22-dihydroporphine Formula: C38H34N4S2 MolecularWeight: 610.83336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C2C=CC(=C(C3=NC(=C(C4=NC(=C(C5=CC=C1N5)C6=CC=CC=C6)C=C4)SCCC)C=C3)C7=CC=CC=C7)N2

Isomeric SMILES

CCCSC1=C2C=CC(=C(C3=NC(=C(C4=NC(=C(C5=CC=C1N5)C6=CC=CC=C6)C=C4)SCCC)C=C3)C7=CC=CC=C7)N2

InChI

InChI=1S/C38H34N4S2/c1-3-23-43-37-31-19-15-27(39-31)35(25-11-7-5-8-12-25)29-17-21-33(41-29)38(44-24-4-2)34-22-18-30(42-34)36(26-13-9-6-10-14-26)28-16-20-32(37)40-28/h5-22,39-40H,3-4,23-24H2,1-2H3