(2Z)-3-oxidanylidene-2-[3-oxidanylidene-7-(pyren-2-ylcarbamoyl)-1-benzothiophen-2-ylidene]-N-pyren-2-yl-1-benzothiophene-7-carboxamide

Systemtic Name: (2Z)-3-oxidanylidene-2-[3-oxidanylidene-7-(pyren-2-ylcarbamoyl)-1-benzothiophen-2-ylidene]-N-pyren-2-yl-1-benzothiophene-7-carboxamide Openeye Name: (2Z)-3-oxo-2-[3-oxo-7-(pyren-2-ylcarbamoyl)benzothiophen-2-ylidene]-N-pyren-2-yl-benzothiophene-7-carboxamide CAS Name: (2Z)-3-oxo-2-[3-oxo-7-[oxo-(2-pyrenylamino)methyl]-1-benzothiophen-2-ylidene]-N-(2-pyrenyl)-1-benzothiophene-7-carboxamide IUPAC Name: (2Z)-3-oxo-2-[3-oxo-7-(pyren-2-ylcarbamoyl)-1-benzothiophen-2-ylidene]-N-pyren-2-yl-1-benzothiophene-7-carboxamide Traditional Name: (2Z)-3-keto-2-[3-keto-7-(pyren-2-ylcarbamoyl)benzothiophen-2-ylidene]-N-pyren-2-yl-benzothiophene-7-carboxamide Formula: C50H26N2O4S2 MolecularWeight: 782.88244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=CC4=C3C(=CC(=C4)NC(=O)C5=CC=CC6=C5SC(=C7C(=O)C8=C(S7)C(=CC=C8)C(=O)NC9=CC1=C3C(=C9)C=CC4=C3C(=CC=C4)C=C1)C6=O)C=C2

Isomeric SMILES

C1=CC2=C3C(=C1)C=CC4=C3C(=CC(=C4)NC(=O)C5=CC=CC6=C5S/C(=C\7/C(=O)C8=C(S7)C(=CC=C8)C(=O)NC9=CC1=C3C(=C9)C=CC4=C3C(=CC=C4)C=C1)/C6=O)C=C2

InChI

InChI=1S/C50H26N2O4S2/c53-43-35-9-3-11-37(49(55)51-33-21-29-17-13-25-5-1-6-26-14-18-30(22-33)41(29)39(25)26)45(35)57-47(43)48-44(54)36-10-4-12-38(46(36)58-48)50(56)52-34-23-31-19-15-27-7-2-8-28-16-20-32(24-34)42(31)40(27)28/h1-24H,(H,51,55)(H,52,56)/b48-47-