Vitas-M small molecule compound
5-(difluoromethyl)-1-(propan-2-yl)-2-sulfanyl-7-(tricyclo[3.3.1.1~3,7~]dec-1-yl)pyrido[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STL179207
SMILES FC(c1cc(nc2c1c(=O)nc(n2C(C)C)S)C12CC3CC(C2)CC(C1)C3)F
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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 C21H25F2N3OS MW 405.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25F2N3OS/c1-10(2)26-18-16(19(27)25-20(26)28)14(17(22)23)6-15(24-18)21-7-11-3-12(8-21)5-13(4-11)9-21/h6,10-13,17H,3-5,7-9H2,1-2H3,(H,25,27,28)InChIKey
VTPZPNDSFVDYGC-UHFFFAOYSA-NSynonyms
1011383-93-91011383939
5(difluoromethyl)1(propan2yl)2sulfanyl7(tricyclo(3311~37~)dec1yl)pyrido(23d)pyrimidin4(1H)one
7(1adamantyl)5(difluoromethyl)1propan2yl2sulfanylidenepyrido(23d)pyrimidin4one
CC(C)N1C2=C(C(=CC(=N2)C34CC5CC(C3)CC(C5)C4)C(F)F)C(=O)NC1=S
InChI=1SC21H25F2N3OSc110(2)261816(19(27)2520(26)28)14(17(22)23)615(2418)21711312(821)513(411)921h6101317H3579H212H3(H252728)
ZINC000020603445
ZINC20603445
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