Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L5Y2WG
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| Ligand Name |
(3r,6r,9ar)-2,2-Dimethyl-6-[(N-Methyl-L-Alanyl)amino]-N-(3-Methyl-1-Phenyl-1h-Pyrazol-5-Yl)-5-Oxo-2,3,5,6,9,9a-Hexahydro[1,3]thiazolo[3,2-A]azepine-3-Carboxamide
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| Synonyms |
(3r,6r,9ar)-2,2-Dimethyl-6-[(N-Methyl-L-Alanyl)amino]-N-(3-Methyl-1-Phenyl-1h-Pyrazol-5-Yl)-5-Oxo-2,3,5,6,9,9a-Hexahydro[1,3]thiazolo[3,2-A]azepine-3-Carboxamide; Q27456157
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| Structure |
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Download2D MOL |
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| Formula |
C25H32N6O3S
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| Canonical SMILES |
CC1=NN(C(=C1)NC(=O)C2C(SC3N2C(=O)C(C=CC3)NC(=O)C(C)NC)(C)C)C4=CC=CC=C4
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| InChI |
1S/C25H32N6O3S/c1-15-14-19(31(29-15)17-10-7-6-8-11-17)28-23(33)21-25(3,4)35-20-13-9-12-18(24(34)30(20)21)27-22(32)16(2)26-5/h6-12,14,16,18,20-21,26H,13H2,1-5H3,(H,27,32)(H,28,33)/t16-,18+,20+,21+/m0/s1
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| InChIKey |
WIYCWFZPNIUIGJ-RCVZYCBYSA-N
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| PubChem Compound ID | ||||
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