Chemical Compound

2-cyano-3-[3-hexyl-5-(7-{4-hexyl-5-[7,12,17-tris(4-methylphenyl)-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]thiophen-2-yl}-2,1,3-benzothiadiazol-4-yl)thiophen-2-yl]prop-2-enoic acid

2-cyano-3-[3-hexyl-5-(7-{4-hexyl-5-[7,12,17-tris(4-methylphenyl)-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]thiophen-2-yl}-2,1,3-benzothiadiazol-4-yl)thiophen-2-yl]prop-2-enoic acid 结构式
Primary record

2-cyano-3-[3-hexyl-5-(7-{4-hexyl-5-[7,12,17-tris(4-methylphenyl)-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]thiophen-2-yl}-2,1,3-benzothiadiazol-4-yl)thiophen-2-yl]prop-2-enoic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177487030
SMILES
CCCCCCC1=C(SC(=C1)C2=CC=C(C3=NSN=C23)C4=CC(=C(S4)C5=C6C=CC(=N6)C(=C7C=CC(=C(C8=NC(=C(C9=CC=C5N9)C1=CC=C(C=C1)C)C=C8)C1=CC=C(C=C1)C)N7)C1=CC=C(C=C1)C)CCCCCC)/C=C(/C#N)\C(=O)O
Canonical SMILES
CCCCCCc1cc(-c2ccc(-c3cc(CCCCCC)c(-c4c5nc(c(-c6ccc(C)cc6)c6ccc([nH]6)c(-c6ccc(C)cc6)c6nc(c(-c7ccc(C)cc7)c7ccc4[nH]7)C=C6)C=C5)s3)c3nsnc23)sc1/C=C(/C#N)C(=O)O

名称与同义词

  • J3.058.915G
  • 2-cyano-3-[3-hexyl-5-(7-{4-hexyl-5-[7,12,17-tris(4-methylphenyl)-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]thiophen-2-yl}-2,1,3-benzothiadiazol-4-yl)thiophen-2-yl]prop-2-enoic acid
  • 5-[5-[7-[5-(2-Carboxy-2-cyanoethenyl)-4-hexyl-2-thienyl]-2,1,3-benzothiadiazole-4-yl]-3-hexyl-2-thienyl]-10,15,20-tris(4-methylphenyl)-21H,23H-porphyrin