Vitas-M small molecule compound
(5Z)-2-[(2-chlorophenyl)amino]-5-[2-hydroxy-5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)benzylidene]-1,3-thiazol-4(5H)-one
Catalog ID
STL406946
SMILES O=C1N=C(S/C/1=C\c1cc(ccc1O)C12CC3CC(C2)CC(C1)C3)Nc1ccccc1Cl
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C26H25ClN2O2S MW 465.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN2O2S/c27-20-3-1-2-4-21(20)28-25-29-24(31)23(32-25)11-18-10-19(5-6-22(18)30)26-12-15-7-16(13-26)9-17(8-15)14-26/h1-6,10-11,15-17,30H,7-9,12-14H2,(H,28,29,31)/b23-11-InChIKey
UPATUKMYHIAPRS-KSEXSDGBSA-NSynonyms
(5Z)2((2chlorophenyl)amino)5(2hydroxy5(tricyclo(3311~37~)dec1yl)benzylidene)13thiazol4(5H)one
(5Z)5((5(1adamantyl)2hydroxyphenyl)methylidene)2(2chloroanilino)13thiazol4one
C1C2CC3CC1CC(C2)(C3)C4=CC(=C(C=C4)O)C=C5C(=O)N=C(S5)NC6=CC=CC=C6Cl
InChI=1SC26H25ClN2O2Sc2720312421(20)28252924(31)23(3225)11181019(5622(18)30)261215716(1326)917(815)1426h161011151730H791214H2(H282931)b2311
O=C1N=C(SC1=Cc1cc(ccc1O)C12CC3CC(C2)CC(C1)C3)Nc1ccccc1Cl
ZINC000108450480
ZINC108450480
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