主记录
AC1MTT4T
- CAS
- 41108-33-2
- PubChem CID
- 3607435
- SMILES
- CC(ON1C(=O)C2=CC=CC=C2C1=O)SC3=CC=CC=C3
- 分子式
- C16H13NO3S
- 分子量
- 299.351
- 精确分子量
- 299.0616
- InChI
- InChI=1S/C16H13NO3S/c1-11(21-12-7-3-2-4-8-12)20-17-15(18)13-9-5-6-10-14(13)16(17)19/h2-11H,1H3
- InChIKey
- HVYIJFVPMNBTSK-UHFFFAOYSA-N
- LogP
- 3.3525
- TPSA
- 46.61
名称与别名
- AC1MTT4T
- Oprea1_291876
- ZINC00481829
- 2-(1-phenylsulfanylethoxy)isoindole-1,3-dione
- CID3607435
- 2-[1-(phenylsulfanyl)ethoxy]-1H-isoindole-1,3(2H)-dione
- AK-564/14607045
- 41108-33-2