BN 50739
HIT212712302
sdf文件结构编辑类似物检索
HIT ID: HIT212712302
Cas No: 128672-07-1
分子式: C28H26ClN5O2S3
分子量: 596.18
常用名: BN 50739
氢键受体数 (HBA): 5
氢键供体数 (HBD): 0
LogP: 4.8761945
IUPAC: 1-[9-(2-chlorophenyl)-3-methyl-17-thia-2,4,5,8,14-pentaazatetracyclo[8.7.0.0^{2,6}.0^{11,16}]heptadeca-1(10),3,5,8,11(16)-pentaen-14-yl]-2-[(3,4-dimethoxyphenyl)sulfanyl]ethane-1-thione
IUPAC: 1-[9-(2-chlorophenyl)-3-methyl-17-thia-2,4,5,8,14-pentaazatetracyclo[8.7.0.0^{2,6}.0^{11,16}]heptadeca-1(10),3,5,8,11(16)-pentaen-14-yl]-2-[(3,4-dimethoxyphenyl)sulfanyl]ethane-1-thione
SMILES: COc1ccc(SCC(=S)N2CCc3c(C2)sc-2c3C(=NCc3nnc(C)n-23)c2ccccc2Cl)cc1OC |c:21|
SMILES: COc1ccc(SCC(=S)N2CCc3c(C2)sc-2c3C(=NCc3nnc(C)n-23)c2ccccc2Cl)cc1OC |c:21|
InChI key: MRVWRDZEYURFSW-UHFFFAOYSA-N
共显示1个结果
供应商规格单价货期纯度操作
TargetMol
SC
150008-10周 购物车
TargetMol | Target Loading
正在加载 ~