Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LB25IJ
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| Ligand Name |
N-[(2s)-1-({2-[5-Chloro-2-(1h-Tetrazol-1-Yl)phenyl]ethyl}amino)-1-Oxo-3-Phenylpropan-2-Yl]-3-Oxo-3,4-Dihydro-2h-1,4-Benzothiazine-7-Carboxamide
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| Synonyms |
N-[(2s)-1-({2-[5-Chloro-2-(1h-Tetrazol-1-Yl)phenyl]ethyl}amino)-1-Oxo-3-Phenylpropan-2-Yl]-3-Oxo-3,4-Dihydro-2h-1,4-Benzothiazine-7-Carboxamide; SCHEMBL3012699; Q27464038; O61
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| Structure |
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Download2D MOL |
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| Formula |
C27H24ClN7O3S
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| Canonical SMILES |
C1C(=O)NC2=C(S1)C=C(C=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)NCCC4=C(C=CC(=C4)Cl)N5C=NN=N5
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| InChI |
1S/C27H24ClN7O3S/c28-20-7-9-23(35-16-30-33-34-35)18(13-20)10-11-29-27(38)22(12-17-4-2-1-3-5-17)32-26(37)19-6-8-21-24(14-19)39-15-25(36)31-21/h1-9,13-14,16,22H,10-12,15H2,(H,29,38)(H,31,36)(H,32,37)/t22-/m0/s1
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| InChIKey |
IAXDWTLDVZYTHX-QFIPXVFZSA-N
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| PubChem Compound ID | ||||
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