Ligand Information
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| Ligand ID |
LE4B0Q
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| Ligand Name |
5-[3-[4-(Aminomethyl)phenoxy]propyl]-2-[(8e)-8-(1,3-Benzothiazol-2-Ylhydrazinylidene)-6,7-Dihydro-5h-Naphthalen-2-Yl]-1,3-Thiazole-4-Carboxylic Acid
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| Synonyms |
WEHI-539; 1431866-33-9; CHEMBL3342187; 5-[3-[4-(Aminomethyl)phenoxy]propyl]-2-[(8e)-8-(1,3-Benzothiazol-2-Ylhydrazinylidene)-6,7-Dihydro-5h-Naphthalen-2-Yl]-1,3-Thiazole-4-Carboxylic Acid; (E)-5-(3-(4-(aminomethyl)phenoxy)propyl)-2-(8-(2-(benzo[d]thiazol-2-yl)hydrazono)-5,6,7,8-tetrahydronaphthalen-2-yl)thiazole-4-carboxylic acid; 5-(3-(4-(Aminomethyl)phenoxy)propyl)-2-(8-(2-(benzo[d]thiazol-2-yl)hydrazono)-5,6,7,8-tetrahydronaphthalen-2-yl)thiazole-4-carboxylic acid; WEHI 539; SCHEMBL18244614; DTXSID20744277; BDBM109236; AMY10375; EX-A1595; BDBM50030764; ZINC100285165; CS-1330; WEHI-539 ( CT-WE539); NCGC00379003-03; NCGC00379003-04; NCGC00379003-09; 5-[3-[4-(Aminomethyl)phenoxy]propyl]-2-[8-[2-(2-benzothiazolyl)hydrazinylidene]-5,6,7,8-tetrahydro-2-naphthalenyl]-4-thiazolecarboxylic Acid; AC-35984; AS-16781; BW165875; HY-15607; A13005; EN300-19767266; 5-[3-[4-(Aminomethyl)phenoxy]propyl]-2-[8-[2-(2- benzothiazolyl)hydrazinylidene]-5,6,7,8-tetrahydro-2- naphthalenyl]-4-thiazolecarboxylic acid; 5-{3-[4-(aminomethyl)phenoxy]propyl}-2-[(8E)-8-[2-(1,3-benzothiazol-2-yl)hydrazin-1-ylidene]-5,6,7,8-tetrahydronaphthalen-2-yl]-1,3-thiazole-4-carboxylic acid; 5-{3-[4-(Aminomethyl)phenoxy]propyl}-2-{(8E)-8-[2-(1,3-benzothiazol-2-yl)hydrazinylidene]-5,6,7,8-tetrahydronaphthalen-2-yl}-1,3-thiazole-4-carboxylic acid; 5-{3-[4-(aminomethyl)phenoxy]propyl}-2-{8-[2-(1,3-benzothiazol-2-yl)hydrazin-1-ylidene]-5,6,7,8-tetrahydronaphthalen-2-yl}-1,3-thiazole-4-carboxylic acid
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| Structure |
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Download2D MOL |
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| Formula |
C31H29N5O3S2
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| Canonical SMILES |
C1CC2=C(C=C(C=C2)C3=NC(=C(S3)CCCOC4=CC=C(C=C4)CN)C(=O)O)C(=NNC5=NC6=CC=CC=C6S5)C1
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| InChI |
1S/C31H29N5O3S2/c32-18-19-10-14-22(15-11-19)39-16-4-9-27-28(30(37)38)34-29(40-27)21-13-12-20-5-3-7-24(23(20)17-21)35-36-31-33-25-6-1-2-8-26(25)41-31/h1-2,6,8,10-15,17H,3-5,7,9,16,18,32H2,(H,33,36)(H,37,38)/b35-24+
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| InChIKey |
JKMWZKPAXZBYEH-JWHWKPFMSA-N
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| PubChem Compound ID | ||||
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