Formula |
C17H21N5O9S2 |
IUPAC Name |
methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-4-(methanesulfonamidomethyl)benzoate |
Molecular Mass |
503.507 g·mol−1 |
Heat of Formation |
-1313.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.18 ± 1.08 D |
Volume |
533.75 Å 3 |
Surface Area |
428.23 Å 2 |
HOMO Energy |
-9.41 ± 0.55 eV |
LUMO Energy |
-1.00 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-4-(methanesulfonamidomethyl)benzoic acid methyl ester
- 2-[[[(4,6-dimethoxy-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]-4-(methanesulfonamidomethyl)benzoic acid methyl ester
- methyl 2-({[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]amino}sulfonyl)-4-{[(methylsulfonyl)amino]methyl}benzoate
- methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-4-(methylsulfonylaminomethyl)benzoate
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CAS Number(s) |
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InChIKey |
NIFKBBMCXCMCAO-UHFFFAOYSA-N |
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Links |
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Elements |
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