Cas no 956534-58-0 (1H-Pyrazole-4-carbothioamide,5-amino-1-methyl-)
956534-58-0 structure
Product Name:1H-Pyrazole-4-carbothioamide,5-amino-1-methyl-
CAS No:956534-58-0
MF:C5H8N4S
MW:156.208818435669
CID:802683
PubChem ID:16637225
Update Time:2025-04-19
1H-Pyrazole-4-carbothioamide,5-amino-1-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrazole-4-carbothioamide,5-amino-1-methyl-
- 1H-Pyrazole-4-carbothioamide, 5-amino-1-methyl-
- 5-amino-1-methyl-1H-pyrazole-4-carbothioamide
- AKOS000269769
- DTXSID301251388
- 956534-58-0
- BB 0219801
-
- Inchi： 1S/C5H8N4S/c1-9-4(6)3(2-8-9)5(7)10/h2H,6H2,1H3,(H2,7,10)
- InChI Key： IPUMHUUWBLQXFJ-UHFFFAOYSA-N
- SMILES： S=C(C1C=NN(C)C=1N)N
Computed Properties
- Exact Mass: 156.04696745g/mol
- Monoisotopic Mass: 156.04696745g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 149
- 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: -0.1
- Topological Polar Surface Area: 102?2
1H-Pyrazole-4-carbothioamide,5-amino-1-methyl- Related Literature
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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