Formula |
C30H34N6O5S |
IUPAC Name |
1-[5-[(5-tert-butyl-3-methanesulfonamido-2-methoxyphenyl)carbamoyl]-2-methylphenyl]-n-(phenylmethyl)triazole-4-carboxamide |
Molecular Mass |
590.693 g·mol−1 |
Heat of Formation |
-410.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.42 ± 1.08 D |
Volume |
695.27 Å 3 |
Surface Area |
592.68 Å 2 |
HOMO Energy |
-8.73 ± 0.55 eV |
LUMO Energy |
-1.09 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 1-[5-[(5-tert-butyl-3-methanesulfonamido-2-methoxy-phenyl)carbamoyl]-2-methyl-phenyl]-n-(phenylmethyl)triazole-4-carboxamide
- 1-[5-[[(5-tert-butyl-3-methanesulfonamido-2-methoxyphenyl)amino]-oxomethyl]-2-methylphenyl]-n-(phenylmethyl)-4-triazolecarboxamide
- 1-[5-[[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]carbamoyl]-2-methyl-phenyl]-n-(phenylmethyl)-1,2,3-triazole-4-carboxamide
- n-(benzyl)-1-[5-[(5-tert-butyl-3-methanesulfonamido-2-methoxy-phenyl)carbamoyl]-2-methyl-phenyl]triazole-4-carboxamide
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InChIKey |
YVIHJEHDPKKGMU-UHFFFAOYSA-N |
QR Code |
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Links |
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Elements |
H
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