| Formula |
C21H23N7O3S2 |
| IUPAC Name |
4-[(2e)-4-methyl-2-methylimino-thiazol-5-yl]-2-(4-methyl-3-morpholinosulfonyl-anilino)pyrimidine-5-carbonitrile |
| Molecular Mass |
485.582 g·mol−1 |
| Heat of Formation |
-21.8 ± 16.7 kJ·mol−1 |
| Dipole Moment |
6.81 ± 1.08 D |
| Volume |
535.32 Å 3 |
| Surface Area |
457.39 Å 2 |
| HOMO Energy |
-8.35 ± 0.55 eV |
| LUMO Energy |
1.78 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
SSEDQERECATUBR-UHFFFAOYSA-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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