Formula |
C22H26ClN7O2S |
IUPAC Name |
acetylene; 2-chloropenta-2,3-dienenitrile; formaldehyde; hydrogen sulfide; methylidyne(methylidyneammoniomethyl)ammonium; methylidyne-[1,3,3-tris(methylidyneammonio)propa-1,2-dienyl]ammonium; prop-1-yne; hydrate |
Molecular Mass |
488.006 g·mol−1 |
Heat of Formation |
-42.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.78 ± 1.08 D |
Volume |
550.54 Å 3 |
Surface Area |
464.11 Å 2 |
HOMO Energy |
-8.64 ± 0.55 eV |
LUMO Energy |
-1.13 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 1n1
- 5-thiazolecarboxamide, n-(2-chloro-6-methylphenyl)-2-((6-(4-(2-hydroxyethyl)-1-piperazinyl)-2-methyl-4-pyrimidinyl)amino)-
- bcb03_000715
- bms 354825
- bms-354825
- bms354825
- d03658
- dasatinib (usan)
- n-(2-chloro-6-methyl-phenyl)-2-[[6-[4-(2-hydroxyethyl)piperazin-1-yl]-2-methyl-pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide
- n-(2-chloro-6-methyl-phenyl)-2-[[6-[4-(2-hydroxyethyl)piperazin-1-yl]-2-methyl-pyrimidin-4-yl]amino]thiazole-5-carboxamide
- n-(2-chloro-6-methylphenyl)-2-((6-(4-(2-hydroxyethyl)piperazin-1-yl)-2-methylpyrimidin-4-yl)amino)thiazole-5-carboxamide
- n-(2-chloro-6-methylphenyl)-2-[[6-[4-(2-hydroxyethyl)-1-piperazinyl]-2-methyl-4-pyrimidinyl]amino]-5-thiazolecarboxamide
- n-(2-chloro-6-methylphenyl)-2-[[6-[4-(2-hydroxyethyl)-1-piperazinyl]-2-methyl-4-pyrimidinyl]amino]-5-thiazolecarboxamide, monohydrate
- sprycel
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CAS Number(s) |
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InChIKey |
ZBNZXTGUTAYRHI-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
C
Cl
H
O
N
S
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