Formula |
C20H20BrN3O2S |
IUPAC Name |
n-[2-[[(e)-3-(4-bromophenyl)allyl]amino]ethyl]-4h-isoquinolin-2-ium-4-ide-5-sulfonamide |
Molecular Mass |
446.361 g·mol−1 |
Heat of Formation |
70.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.02 ± 1.08 D |
Volume |
470.84 Å 3 |
Surface Area |
414.34 Å 2 |
HOMO Energy |
-9.30 ± 0.55 eV |
LUMO Energy |
-1.70 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 5-isoquinolinesulfonamide, n-(2-((3-(4-bromophenyl)-2- propenyl)amino)ethyl)-
- 5-isoquinolinesulfonamide, n-(2-((3-(4-bromophenyl)-2-propenyl)amino)ethyl)-
- bio1_000301
- bio1_000790
- bio1_001279
- bio2_000384
- bio2_000864
- cbiol_002015
- h 89
- h89
- iqb
- n-(2-((3-(4-bromophenyl)-2-propenyl)amino)ehtyl)-5-isoquinolinesulfonamide dihydrochloride
- n-(2-(4-bromocinnamylamino)ethyl)-5-isoquinolinesulfonamide
- n-[2-(4-bromocinnamylamino)ethyl]-5-isoquinoline sulfonamide
- n-[2-[3-(4-bromophenyl)prop-2-enylamino]ethyl]-5-isoquinolinesulfonamide
- n-[2-[3-(4-bromophenyl)prop-2-enylamino]ethyl]isoquinoline-5-sulfonamide
- n-[2-[[(e)-3-(4-bromophenyl)prop-2-enyl]amino]ethyl]-5-isoquinolinesulfonamide
- n-[2-[[(e)-3-(4-bromophenyl)prop-2-enyl]amino]ethyl]isoquinoline-5-sulfonamide
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CAS Number(s) |
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InChIKey |
ZKZXNDJNWUTGDK-NSCUHMNNSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
C
H
O
N
S
Br
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