Chemical Compound

3-{5-[7,12-bis({4-methyl-3-[(phenylcarbamoyl)amino]phenyl})-17-[4-(2-{4-[7,12,17-tris(4-octylphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]phenyl}ethynyl)phenyl]-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]-2-methylphenyl}-1-phenylurea

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3-{5-[7,12-bis({4-methyl-3-[(phenylcarbamoyl)amino]phenyl})-17-[4-(2-{4-[7,12,17-tris(4-octylphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]phenyl}ethynyl)phenyl]-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]-2-methylphenyl}-1-phenylurea 结构式
Primary record

3-{5-[7,12-bis({4-methyl-3-[(phenylcarbamoyl)amino]phenyl})-17-[4-(2-{4-[7,12,17-tris(4-octylphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]phenyl}ethynyl)phenyl]-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]-2-methylphenyl}-1-phenylurea

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177574569
SMILES
CCCCCCCCC1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)CCCCCCCC)C8=CC=C(C=C8)C#CC9=CC=C(C=C9)C1=C2C=CC(=C(C5=NC(=C(C6=CC=C(N6)C(=C6C=CC1=N6)C1=CC(=C(C=C1)C)NC(=O)NC1=CC=CC=C1)C1=CC(=C(C=C1)C)NC(=O)NC1=CC=CC=C1)C=C5)C1=CC(=C(C=C1)C)NC(=O)NC1=CC=CC=C1)N2)C=C4)C1=CC=C(C=C1)CCCCCCCC)N3
Canonical SMILES
CCCCCCCCc1ccc(-c2c3nc(c(-c4ccc(CCCCCCCC)cc4)c4ccc([nH]4)c(-c4ccc(CCCCCCCC)cc4)c4nc(c(-c5ccc(C#Cc6ccc(-c7c8nc(c(-c9ccc(C)c(NC(=O)Nc%10ccccc%10)c9)c9ccc([nH]9)c(-c9ccc(C)c(NC(=O)Nc%10ccccc%10)c9)c9nc(c(-c%10ccc(C)c(NC(=O)Nc%11ccccc%11)c%10)c%10ccc7[nH]%10)C=C9)C=C8)cc6)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1

名称与同义词

  • J2.063.948B
  • 1-[4-[10,15,20-Tris(4-octylphenyl)-21H,23H-porphyrin-5-yl]phenyl]-2-[4-[10,15,20-tris[3-(3-phenylureido)-4-methylphenyl]-21H,23H-porphyrin-5-yl]phenyl]ethyne
  • 3-{5-[7,12-bis({4-methyl-3-[(phenylcarbamoyl)amino]phenyl})-17-[4-(2-{4-[7,12,17-tris(4-octylphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]phenyl}ethynyl)phenyl]-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]-2-methylphenyl}-1-phenylurea