Chemical Compound

[(4-{[5,9-bis(4-methylbenzenesulfonyl)-1H,4H,5H,6H,7H,8H,9H,10H-[1,2,3]triazolo[4,5-g][1,5]diazonin-1-yl]methyl}phenyl)methyl](6-{4-[7,12,17-tris({4-[(6-{[(4-{[5,9-bis(4-methylbenzenesulfonyl)-1H,4H,5H,6H,7H,8H,9H,10H-[1,2,3]triazolo[4,5-g][1,5]diazonin-1-yl]methyl}phenyl)methyl]amino}hexyl)oxy]phenyl})-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]phenoxy}hexyl)amine

[(4-{[5,9-bis(4-methylbenzenesulfonyl)-1H,4H,5H,6H,7H,8H,9H,10H-[1,2,3]triazolo[4,5-g][1,5]diazonin-1-yl]methyl}phenyl)methyl](6-{4-[7,12,17-tris({4-[(6-{[(4-{[5,9-bis(4-methylbenzenesulfonyl)-1H,4H,5H,6H,7H,8H,9H,10H-[1,2,3]triazolo[4,5-g][1,5]diazonin-1-yl]methyl}phenyl)methyl]amino}hexyl)oxy]phenyl})-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]phenoxy}hexyl)amine 结构式
Primary record

[(4-{[5,9-bis(4-methylbenzenesulfonyl)-1H,4H,5H,6H,7H,8H,9H,10H-[1,2,3]triazolo[4,5-g][1,5]diazonin-1-yl]methyl}phenyl)methyl](6-{4-[7,12,17-tris({4-[(6-{[(4-{[5,9-bis(4-methylbenzenesulfonyl)-1H,4H,5H,6H,7H,8H,9H,10H-[1,2,3]triazolo[4,5-g][1,5]diazonin-1-yl]methyl}phenyl)methyl]amino}hexyl)oxy]phenyl})-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]phenoxy}hexyl)amine

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177558191
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC3=C(C2)N=NN3CC4=CC=C(C=C4)CNCCCCCCOC5=CC=C(C=C5)C6=C7C=CC(=C(C8=NC(=C(C9=CC=C(N9)C(=C1C=CC6=N1)C1=CC=C(C=C1)OCCCCCCNCC1=CC=C(C=C1)CN1C2=C(CN(CCCN(C2)S(=O)(=O)C2=CC=C(C=C2)C)S(=O)(=O)C2=CC=C(C=C2)C)N=N1)C1=CC=C(C=C1)OCCCCCCNCC1=CC=C(C=C1)CN1C2=C(CN(CCCN(C2)S(=O)(=O)C2=CC=C(C=C2)C)S(=O)(=O)C2=CC=C(C=C2)C)N=N1)C=C8)C1=CC=C(C=C1)OCCCCCCNCC1=CC=C(C=C1)CN1C2=C(CN(CCCN(C2)S(=O)(=O)C2=CC=C(C=C2)C)S(=O)(=O)C2=CC=C(C=C2)C)N=N1)N7)S(=O)(=O)C1=CC=C(C=C1)C
Canonical SMILES
Cc1ccc(S(=O)(=O)N2CCCN(S(=O)(=O)c3ccc(C)cc3)Cc3c(nnn3Cc3ccc(CNCCCCCCOc4ccc(-c5c6nc(c(-c7ccc(OCCCCCCNCc8ccc(Cn9nnc%10c9CN(S(=O)(=O)c9ccc(C)cc9)CCCN(S(=O)(=O)c9ccc(C)cc9)C%10)cc8)cc7)c7ccc([nH]7)c(-c7ccc(OCCCCCCNCc8ccc(Cn9nnc%10c9CN(S(=O)(=O)c9ccc(C)cc9)CCCN(S(=O)(=O)c9ccc(C)cc9)C%10)cc8)cc7)c7nc(c(-c8ccc(OCCCCCCNCc9ccc(Cn%10nnc%11c%10CN(S(=O)(=O)c%10ccc(C)cc%10)CCCN(S(=O)(=O)c%10ccc(C)cc%10)C%11)cc9)cc8)c8ccc5[nH]8)C=C7)C=C6)cc4)cc3)C2)cc1

名称与同义词

  • J3.688.495I
  • [(4-{[5,9-bis(4-methylbenzenesulfonyl)-1H,4H,5H,6H,7H,8H,9H,10H-[1,2,3]triazolo[4,5-g][1,5]diazonin-1-yl]methyl}phenyl)methyl](6-{4-[7,12,17-tris({4-[(6-{[(4-{[5,9-bis(4-methylbenzenesulfonyl)-1H,4H,5H,6H,7H,8H,9H,10H-[1,2,3]triazolo[4,5-g][1,5]diazonin-1-yl]methyl}phenyl)methyl]amino}hexyl)oxy]phenyl})-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]phenoxy}hexyl)amine
  • 5,10,15,20-Tetrakis[4-[[6-[[4-[[5,9-ditosyl-5,6,7,8,9,10-hexahydro-1,2,3,5,9-pentaazacyclopentacyclononene-1(4H)-yl]methyl]benzyl]amino]hexyl]oxy]phenyl]-21H,23H-porphyrin
  • 5,10,15,20-Tetrakis[4-[6-[4-(5,9-ditosyl-1,2,3,5,9-pentaaza-1,4,5,6,7,8,9,10-octahydrocyclopentacyclononene-1-ylmethyl)benzylamino]hexyloxy]phenyl]-21H,23H-porphyrin