主记录
AC1LKBHI
- CAS
- 331670-21-4
- PubChem CID
- 1040556
- SMILES
- COC1=CC=CC=C1C2=NN(C(=S)O2)CNC3=CC=C(C=C3)I
- 分子式
- C16H14IN3O2S
- 分子量
- 439.278
- 精确分子量
- 438.9851
- InChI
- InChI=1S/C16H14IN3O2S/c1-21-14-5-3-2-4-13(14)15-19-20(16(23)22-15)10-18-12-8-6-11(17)7-9-12/h2-9,18H,10H2,1H3
- InChIKey
- ZCHGLYQYLRNGOT-UHFFFAOYSA-N
- LogP
- 4.5554
- TPSA
- 52.22
名称与别名
- AC1LKBHI
- Oprea1_308970
- Oprea1_530013
- ZCHGLYQYLRNGOT-UHFFFAOYSA-N
- ZINC712242
- STL595953
- BAS 00395382
- AKOS000608976
- CID1040556
- ST50227236
- AG-205/33682055
- 3-[(4-iodoanilino)methyl]-5-(2-methoxyphenyl)-1,3,4-oxadiazole-2(3H)-thione
- 3-[(4-iodoanilino)methyl]-5-(2-methoxyphenyl)-1,3,4-oxadiazole-2-thione
- 331670-21-4
- 3-{[(4-iodophenyl)amino]methyl}-5-(2-methoxyphenyl)-1,3,4-oxadiazole-2(3H)-thione
- 3-{[(4-iodophenyl)amino]methyl}-5-(2-methoxyphenyl)-1,3,4-oxadiazoline-2-thion e