N,N'-bis(3-methylsulfanylacridin-9-yl)octane-1,8-diamine

Systemtic Name: N,N'-bis(3-methylsulfanylacridin-9-yl)octane-1,8-diamine Openeye Name: N,N'-bis(3-methylsulfanylacridin-9-yl)octane-1,8-diamine CAS Name: N,N'-bis[3-(methylthio)-9-acridinyl]octane-1,8-diamine IUPAC Name: N,N'-bis(3-methylsulfanylacridin-9-yl)octane-1,8-diamine Traditional Name: [3-(methylthio)acridin-9-yl]-[8-[[3-(methylthio)acridin-9-yl]amino]octyl]amine Formula: C36H38N4S2 MolecularWeight: 590.84372

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC3=CC=CC=C3C(=C2C=C1)NCCCCCCCCNC4=C5C=CC(=CC5=NC6=CC=CC=C64)SC

Isomeric SMILES

CSC1=CC2=NC3=CC=CC=C3C(=C2C=C1)NCCCCCCCCNC4=C5C=CC(=CC5=NC6=CC=CC=C64)SC

InChI

InChI=1S/C36H38N4S2/c1-41-25-17-19-29-33(23-25)39-31-15-9-7-13-27(31)35(29)37-21-11-5-3-4-6-12-22-38-36-28-14-8-10-16-32(28)40-34-24-26(42-2)18-20-30(34)36/h7-10,13-20,23-24H,3-6,11-12,21-22H2,1-2H3,(H,37,39)(H,38,40)