Cas no 957061-89-1 (Acetamide,N-[4-(cyanomethyl)-2-thiazolyl]-)
![Acetamide,N-[4-(cyanomethyl)-2-thiazolyl]- structure](https://ossimg.kuujia.com/scimg/957500/957061-89-1x500.png)
957061-89-1 structure
Product Name:Acetamide,N-[4-(cyanomethyl)-2-thiazolyl]-
CAS No:957061-89-1
MF:C7H7N3OS
MW:181.214979410172
CID:802739
PubChem ID:45119582
Update Time:2025-04-19
Acetamide,N-[4-(cyanomethyl)-2-thiazolyl]- Chemical and Physical Properties
Names and Identifiers
-
- Acetamide,N-[4-(cyanomethyl)-2-thiazolyl]-
- ACETAMIDE,N-[4-(CYANOMETHYL)-THIAZOL-2-YL]-
- 957061-89-1
- SCHEMBL3904033
-
- Inchi： 1S/C7H7N3OS/c1-5(11)9-7-10-6(2-3-8)4-12-7/h4H,2H2,1H3,(H,9,10,11)
- InChI Key： YTSASKYLPVTEHU-UHFFFAOYSA-N
- SMILES： S1C=C(CC#N)N=C1NC(C)=O
Computed Properties
- Exact Mass: 181.03098303g/mol
- Monoisotopic Mass: 181.03098303g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 222
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.2
- Topological Polar Surface Area: 94?2
Acetamide,N-[4-(cyanomethyl)-2-thiazolyl]- Related Literature
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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