Formula |
C10H15N7OS |
IUPAC Name |
3-cyano-1-methyl-2-[2-[(5-methyl-1h-imidazol-4-yl)methylsulfanyl]ethyl]-1-nitroso-guanidine |
Molecular Mass |
281.337 g·mol−1 |
Heat of Formation |
382.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.80 ± 1.08 D |
Volume |
339.11 Å 3 |
Surface Area |
293.52 Å 2 |
HOMO Energy |
-8.14 ± 0.55 eV |
LUMO Energy |
-0.57 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-cyano-1-methyl-3-(2-{[(4-methyl-1h-imidazol-5-yl)methyl]thio}ethyl)-1-nitrosoguanidine
- 3-cyano-1-methyl-2-[2-[(5-methyl-1h-imidazol-4-yl)methylsulfanyl]ethyl]-1-nitroso-guanidine
- 3-cyano-1-methyl-2-[2-[(5-methyl-1h-imidazol-4-yl)methylsulfanyl]ethyl]-1-nitrosoguanidine
- 3-cyano-1-methyl-2-[2-[(5-methyl-1h-imidazol-4-yl)methylthio]ethyl]-1-nitroso-guanidine
- 3-cyano-1-methyl-2-[2-[(5-methyl-1h-imidazol-4-yl)methylthio]ethyl]-1-nitrosoguanidine
- guanidine, 2-cyano-1-methyl-3-(2-(((5-methylimidazol-4-yl)methyl)thio)ethyl)-1-n
- guanidine, 2-cyano-1-methyl-3-(2-(((5-methylimidazol-4-yl)methyl)thio)ethyl)-1-nitroso-
- guanidine, n'-cyano-n-methyl-n''-(2-(((5-methyl-1h-imidazol-4-yl)methyl)thio)ethyl)-n-nitroso-
- n-nitrosocimetidine
- nitrocimetidine
- nitrosocimetidine
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CAS Number(s) |
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InChIKey |
LFTUYYPQNCJQGN-UHFFFAOYSA-N |
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Links |
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Elements |
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