Formula |
C17H27N3O3S |
IUPAC Name |
(2s)-n-[(1s)-3-hydroxy-1-(hydroxymethyl)propyl]-4-methyl-2-(phenylcarbamothioylamino)pentanamide |
Molecular Mass |
353.480 g·mol−1 |
Heat of Formation |
-507.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.05 ± 1.08 D |
Volume |
446.37 Å 3 |
Surface Area |
381.61 Å 2 |
HOMO Energy |
-8.26 ± 0.55 eV |
LUMO Energy |
-0.43 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-n-[(1s)-3-hydroxy-1-(hydroxymethyl)propyl]-4-methyl-2-(phenylcarbamothioylamino)pentanamide
- (2s)-n-[(1s)-3-hydroxy-1-(hydroxymethyl)propyl]-4-methyl-2-[[(phenylamino)-thioxomethyl]amino]pentanamide
- (2s)-n-[(1s)-3-hydroxy-1-methylol-propyl]-4-methyl-2-(phenylthiocarbamoylamino)valeramide
- (2s)-n-[(2s)-1,4-dihydroxybutan-2-yl]-4-methyl-2-(phenylcarbamothioylamino)pentanamide
- n~2~-(anilinocarbonothioyl)-n-[(1s)-3-hydroxy-1-(hydroxymethyl)propyl]-l-leucinamide
- snj-1715
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InChIKey |
OXLJDYBAHYSQNA-GJZGRUSLSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
S
O
N
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