Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LF4UX8
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| Ligand Name |
tert-butyl (2-{[(2S)-3-oxo-2-(phenylamino)-3-{[(pyridin-3-yl)methyl]amino}propyl]sulfanyl}ethyl)carbamate
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| Synonyms |
tert-butyl (2-{[(2S)-3-oxo-2-(phenylamino)-3-{[(pyridin-3-yl)methyl]amino}propyl]sulfanyl}ethyl)carbamate; 80K
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| Structure |
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Download2D MOL |
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| Formula |
C22H30N4O3S
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| Canonical SMILES |
CC(C)(C)OC(=O)NCCSCC(C(=O)NCC1=CN=CC=C1)NC2=CC=CC=C2
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| InChI |
1S/C22H30N4O3S/c1-22(2,3)29-21(28)24-12-13-30-16-19(26-18-9-5-4-6-10-18)20(27)25-15-17-8-7-11-23-14-17/h4-11,14,19,26H,12-13,15-16H2,1-3H3,(H,24,28)(H,25,27)/t19-/m1/s1
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| InChIKey |
IEAGHLBQWKIVGS-LJQANCHMSA-N
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| PubChem Compound ID | ||||
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