N2-[4-azanyl-6-(octylamino)-1,3,5-triazin-2-yl]-N2-[4-[[4-[bis[4-azanyl-6-(octylamino)-1,3,5-triazin-2-yl]amino]phenoxy]methoxy]phenyl]-N4-octyl-1,3,5-triazine-2,4,6-triamine

Systemtic Name: N2-[4-azanyl-6-(octylamino)-1,3,5-triazin-2-yl]-N2-[4-[[4-[bis[4-azanyl-6-(octylamino)-1,3,5-triazin-2-yl]amino]phenoxy]methoxy]phenyl]-N4-octyl-1,3,5-triazine-2,4,6-triamine Openeye Name: N2-[4-amino-6-(octylamino)-1,3,5-triazin-2-yl]-N2-[4-[[4-[bis[4-amino-6-(octylamino)-1,3,5-triazin-2-yl]amino]phenoxy]methoxy]phenyl]-N4-octyl-1,3,5-triazine-2,4,6-triamine CAS Name: N2-[4-amino-6-(octylamino)-1,3,5-triazin-2-yl]-N2-[4-[[4-[bis[4-amino-6-(octylamino)-1,3,5-triazin-2-yl]amino]phenoxy]methoxy]phenyl]-N4-octyl-1,3,5-triazine-2,4,6-triamine IUPAC Name: 2-N-[4-amino-6-(octylamino)-1,3,5-triazin-2-yl]-2-N-[4-[[4-[bis[4-amino-6-(octylamino)-1,3,5-triazin-2-yl]amino]phenoxy]methoxy]phenyl]-4-N-octyl-1,3,5-triazine-2,4,6-triamine Traditional Name: bis[4-amino-6-(octylamino)-s-triazin-2-yl]-[4-[[4-[bis[4-amino-6-(octylamino)-s-triazin-2-yl]amino]phenoxy]methoxy]phenyl]amine Formula: C57H90N22O2 MolecularWeight: 1115.4707

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=NC(=NC(=N1)N)N(C2=CC=C(C=C2)OCOC3=CC=C(C=C3)N(C4=NC(=NC(=N4)NCCCCCCCC)N)C5=NC(=NC(=N5)NCCCCCCCC)N)C6=NC(=NC(=N6)NCCCCCCCC)N

Isomeric SMILES

CCCCCCCCNC1=NC(=NC(=N1)N)N(C2=CC=C(C=C2)OCOC3=CC=C(C=C3)N(C4=NC(=NC(=N4)NCCCCCCCC)N)C5=NC(=NC(=N5)NCCCCCCCC)N)C6=NC(=NC(=N6)NCCCCCCCC)N

InChI

InChI=1S/C57H90N22O2/c1-5-9-13-17-21-25-37-62-50-66-46(58)70-54(74-50)78(55-71-47(59)67-51(75-55)63-38-26-22-18-14-10-6-2)42-29-33-44(34-30-42)80-41-81-45-35-31-43(32-36-45)79(56-72-48(60)68-52(76-56)64-39-27-23-19-15-11-7-3)57-73-49(61)69-53(77-57)65-40-28-24-20-16-12-8-4/h29-36H,5-28,37-41H2,1-4H3,(H3,58,62,66,70,74)(H3,59,63,67,71,75)(H3,60,64,68,72,76)(H3,61,65,69,73,77)