Vitas-M small molecule compound
4-({[3-cyano-6-(tricyclo[3.3.1.1~3,7~]dec-1-yl)pyridin-2-yl]sulfanyl}methyl)benzoic acid
Catalog ID
STK027008
SMILES N#Cc1ccc(nc1SCc1ccc(cc1)C(=O)O)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 C24H24N2O2S MW 404.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N2O2S/c25-13-20-5-6-21(24-10-16-7-17(11-24)9-18(8-16)12-24)26-22(20)29-14-15-1-3-19(4-2-15)23(27)28/h1-6,16-18H,7-12,14H2,(H,27,28)InChIKey
BNODDTJWPRVKEK-UHFFFAOYSA-NSynonyms
340817-71-2340817712
4(((3cyano6(tricyclo(3311~37~)dec1yl)pyridin2yl)sulfanyl)methyl)benzoicacid
4(((6((1s3s)adamantan1yl)3cyanopyridin2yl)thio)methyl)benzoicacid
4((6(1ADAMANTYL)3CYANOPYRIDIN2YL)SULFANYLMETHYL)BENZOICACID
C1C2CC3CC1CC(C2)(C3)C4=NC(=C(C=C4)C#N)SCC5=CC=C(C=C5)C(=O)O
InChI=1SC24H24N2O2Sc2513205621(241016717(1124)918(816)1224)2622(20)2914151319(4215)23(27)28h161618H71214H2(H2728)
MFCD01835892
N#Cc1ccc(nc1SCc1ccc(cc1)C(=O)O)C12CC3CC(C2)CC(C1)C3
STK027008
ZINC000004562065
ZINC4562065
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