4,8-bis(decylsulfanyl)-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione

Systemtic Name: 4,8-bis(decylsulfanyl)-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione Openeye Name: 4,8-bis(decylsulfanyl)-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione CAS Name: 4,8-bis(decylthio)-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione IUPAC Name: 4,8-bis(decylsulfanyl)-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione Traditional Name: 4,8-bis(decylthio)-5,12-dihydroquinolin[2,3-b]acridine-7,14-quinone Formula: C40H52N2O2S2 MolecularWeight: 656.98308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC1=CC=CC2=C1C(=O)C3=C(N2)C=C4C(=C3)NC5=C(C4=O)C=CC=C5SCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCSC1=CC=CC2=C1C(=O)C3=C(N2)C=C4C(=C3)NC5=C(C4=O)C=CC=C5SCCCCCCCCCC

InChI

InChI=1S/C40H52N2O2S2/c1-3-5-7-9-11-13-15-17-25-45-35-23-20-22-32-37(35)40(44)31-28-34-30(27-33(31)41-32)39(43)29-21-19-24-36(38(29)42-34)46-26-18-16-14-12-10-8-6-4-2/h19-24,27-28H,3-18,25-26H2,1-2H3,(H,41,44)(H,42,43)