Vitas-M small molecule compound
1-phenyl-2-{[5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-benzoxazol-2-yl]sulfanyl}ethanone
Catalog ID
STK736899
SMILES O=C(c1ccccc1)CSc1nc2c(o1)ccc(c2)C12CC3CC(C2)CC(C1)C3
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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 C25H25NO2S MW 403.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO2S/c27-22(19-4-2-1-3-5-19)15-29-24-26-21-11-20(6-7-23(21)28-24)25-12-16-8-17(13-25)10-18(9-16)14-25/h1-7,11,16-18H,8-10,12-15H2InChIKey
CSLUQGPPZVJGNO-UHFFFAOYSA-NSynonyms
1phenyl2((5(tricyclo(3311~37~)dec1yl)13benzoxazol2yl)sulfanyl)ethanone
2((5(1ADAMANTYL)13BENZOXAZOL2YL)SULFANYL)1PHENYLETHANONE
2(5ADAMANTANYLBENZOXAZOL2YLTHIO)1PHENYLETHAN1ONE
C1C2CC3CC1CC(C2)(C3)C4=CC5=C(C=C4)OC(=N5)SCC(=O)C6=CC=CC=C6
InChI=1SC25H25NO2Sc2722(194213519)15292426211120(6723(21)2824)251216817(1325)1018(916)1425h17111618H8101215H2
MFCD07021832
ZINC000004760903
ZINC04760903
ZINC4760903
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