Molecule

N-[4-(5-bromothiophen-2-yl)phenyl]-4-[5-[2-(12-ethynyl-5-tricyclo[8.2.2.24,7]hexadeca-1(12),4,6,10,13,15-hexaenyl)ethynyl]thiophen-2-yl]-N-(4-methoxyphenyl)aniline

Chemical Information

Molecular Image
InChI InChI=1S/C47H34BrNOS2/c1-3-34-30-32-4-5-33-7-9-36(11-10-35(34)8-6-32)39(31-33)16-25-44-26-27-45(51-44)37-12-17-40(18-13-37)49(42-21-23-43(50-2)24-22-42)41-19-14-38(15-20-41)46-28-29-47(48)52-46/h1,6-9,12-15,17-24,26-31H,4-5,10-11H2,2H3
SMILES COc1ccc(cc1)N(c1ccc(cc1)c1ccc(s1)Br)c1ccc(cc1)c1ccc(s1)C#Cc1cc2CCc3ccc(CCc1cc2)c(c3)C#C
InChI Key QJGQMKUIBKTNLC-UHFFFAOYSA-N
Exact Mass 772.813 g/mol

Metadata Information

Field Value
NFDI4Chem Molecule ID nfdi4chem-mol2130
Source
Alternate Name
    Field Value
    No additional information available for this Dataset.
    Data-Source Molecule ID Data-Source
    175666132 pubchem
    The data in this table is sourced from UniChem at EBI.