Vitas-M small molecule compound
1-phenyl-2-{[4-phenyl-5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK807056
SMILES O=C(c1ccccc1)CSc1nnc(n1c1ccccc1)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 C26H27N3OS MW 429.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3OS/c30-23(21-7-3-1-4-8-21)17-31-25-28-27-24(29(25)22-9-5-2-6-10-22)26-14-18-11-19(15-26)13-20(12-18)16-26/h1-10,18-20H,11-17H2InChIKey
HZFWSEIBXDBIBR-UHFFFAOYSA-NSynonyms
1phenyl2((4phenyl5(tricyclo(3311~37~)dec1yl)4H124triazol3yl)sulfanyl)ethanone
2((5(1ADAMANTYL)4PHENYL124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2(5ADAMANTANYL4PHENYL(124TRIAZOL3YLTHIO))1PHENYLETHAN1ONE
C1C2CC3CC1CC(C2)(C3)C4=NN=C(N4C5=CC=CC=C5)SCC(=O)C6=CC=CC=C6
InChI=1SC26H27N3OSc3023(217314821)173125282724(29(25)2295261022)2614181119(1526)1320(1218)1626h1101820H1117H2
MFCD03621177
ZINC000015441654
ZINC15441654
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