N6-pentyl-N2-[[3-[[[4-(pentylamino)-6-[[3-[[[4-(pentylamino)-6-[(phenylmethyl)amino]-1,3,5-triazin-2-yl]amino]methyl]phenyl]methylamino]-1,3,5-triazin-2-yl]amino]methyl]phenyl]methyl]-N4-(phenylmethyl)-1,3,5-triazine-2,4,6-triamine

Systemtic Name: N6-pentyl-N2-[[3-[[[4-(pentylamino)-6-[[3-[[[4-(pentylamino)-6-[(phenylmethyl)amino]-1,3,5-triazin-2-yl]amino]methyl]phenyl]methylamino]-1,3,5-triazin-2-yl]amino]methyl]phenyl]methyl]-N4-(phenylmethyl)-1,3,5-triazine-2,4,6-triamine Openeye Name: N4-benzyl-N2-[[3-[[[4-[[3-[[[4-(benzylamino)-6-(pentylamino)-1,3,5-triazin-2-yl]amino]methyl]phenyl]methylamino]-6-(pentylamino)-1,3,5-triazin-2-yl]amino]methyl]phenyl]methyl]-N6-pentyl-1,3,5-triazine-2,4,6-triamine CAS Name: N6-pentyl-N2-[[3-[[[4-(pentylamino)-6-[[3-[[[4-(pentylamino)-6-[(phenylmethyl)amino]-1,3,5-triazin-2-yl]amino]methyl]phenyl]methylamino]-1,3,5-triazin-2-yl]amino]methyl]phenyl]methyl]-N4-(phenylmethyl)-1,3,5-triazine-2,4,6-triamine IUPAC Name: 4-N-benzyl-2-N-[[3-[[[4-[[3-[[[4-(benzylamino)-6-(pentylamino)-1,3,5-triazin-2-yl]amino]methyl]phenyl]methylamino]-6-(pentylamino)-1,3,5-triazin-2-yl]amino]methyl]phenyl]methyl]-6-N-pentyl-1,3,5-triazine-2,4,6-triamine Traditional Name: amyl-[4-[[3-[[[4-(amylamino)-6-[[3-[[[4-(amylamino)-6-(benzylamino)-s-triazin-2-yl]amino]methyl]benzyl]amino]-s-triazin-2-yl]amino]methyl]benzyl]amino]-6-(benzylamino)-s-triazin-2-yl]amine Formula: C54H72N18 MolecularWeight: 973.27008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=NC(=NC(=N1)NCC2=CC(=CC=C2)CNC3=NC(=NC(=N3)NCCCCC)NCC4=CC=CC(=C4)CNC5=NC(=NC(=N5)NCC6=CC=CC=C6)NCCCCC)NCC7=CC=CC=C7

Isomeric SMILES

CCCCCNC1=NC(=NC(=N1)NCC2=CC(=CC=C2)CNC3=NC(=NC(=N3)NCCCCC)NCC4=CC=CC(=C4)CNC5=NC(=NC(=N5)NCC6=CC=CC=C6)NCCCCC)NCC7=CC=CC=C7

InChI

InChI=1S/C54H72N18/c1-4-7-16-29-55-46-64-49(58-34-40-21-12-10-13-22-40)70-51(66-46)60-36-42-25-19-27-44(32-42)38-62-53-68-48(57-31-18-9-6-3)69-54(72-53)63-39-45-28-20-26-43(33-45)37-61-52-67-47(56-30-17-8-5-2)65-50(71-52)59-35-41-23-14-11-15-24-41/h10-15,19-28,32-33H,4-9,16-18,29-31,34-39H2,1-3H3,(H3,55,58,60,64,66,70)(H3,56,59,61,65,67,71)(H3,57,62,63,68,69,72)