Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L84HVN
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| Ligand Name |
(5S)-5-{4-[(2S)-2-(1H-benzimidazol-2-yl)-2-(1,3-benzothiazol-2-ylamino)ethyl]phenyl}isothiazolidin-3-one 1,1-dioxide
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| Synonyms |
(5S)-5-{4-[(2S)-2-(1H-benzimidazol-2-yl)-2-(1,3-benzothiazol-2-ylamino)ethyl]phenyl}isothiazolidin-3-one 1,1-dioxide; IZD deriv. 5; 2cnf; CHEMBL440955; BDBM13473; Isothiazolidinone (IZD) deriv. 2; F32; Q27460135; (5S)-3-Oxo-5beta-[4-[(S)-2-(benzothiazole-2-ylamino)-2-(1H-benzoimidazole-2-yl)ethyl]phenyl]isothiazolidine 1,1-dioxide; (5S)-5-{4-[(2S)-2-(1H-1,3-benzodiazol-2-yl)-2-(1,3-benzothiazol-2-ylamino)ethyl]phenyl}-1$l^{6},2-thiazolidine-1,1,3-trione
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| Structure |
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Download2D MOL |
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| Formula |
C25H21N5O3S2
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| Canonical SMILES |
C1C(S(=O)(=O)NC1=O)C2=CC=C(C=C2)CC(C3=NC4=CC=CC=C4N3)NC5=NC6=CC=CC=C6S5
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| InChI |
1S/C25H21N5O3S2/c31-23-14-22(35(32,33)30-23)16-11-9-15(10-12-16)13-20(24-26-17-5-1-2-6-18(17)27-24)29-25-28-19-7-3-4-8-21(19)34-25/h1-12,20,22H,13-14H2,(H,26,27)(H,28,29)(H,30,31)/t20-,22-/m0/s1
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| InChIKey |
CQVSNNWJZWEETM-UNMCSNQZSA-N
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| PubChem Compound ID | ||||
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