Vitas-M small molecule compound
4,7-diamino-2-(methylsulfanyl)-5-[4-(trifluoromethyl)phenyl]-5H-pyrano[2,3-d]pyrimidine-6-carbonitrile
Catalog ID
STK781539
SMILES CSc1nc(N)c2c(n1)OC(=C(C2c1ccc(cc1)C(F)(F)F)C#N)N
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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 C16H12F3N5OS MW 379.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12F3N5OS/c1-26-15-23-12(21)11-10(9(6-20)13(22)25-14(11)24-15)7-2-4-8(5-3-7)16(17,18)19/h2-5,10H,22H2,1H3,(H2,21,23,24)InChIKey
DWYHDFUZCZCWEA-UHFFFAOYSA-NSynonyms
47diamino2(methylsulfanyl)5(4(trifluoromethyl)phenyl)5Hpyrano(23d)pyrimidine6carbonitrile
47DIAMINO2METHYLSULFANYL5(4(TRIFLUOROMETHYL)PHENYL)5HPYRANO(23D)PYRIMIDINE6CARBONITRILE
CSC1=NC(=C2C(C(=C(OC2=N1)N)C#N)C3=CC=C(C=C3)C(F)(F)F)N
InChI=1SC16H12F3N5OSc126152312(21)1110(9(620)13(22)2514(11)2415)7248(537)16(1718)19h2510H22H21H3(H2212324)
MFCD06015262
ZINC000004623325
ZINC000004623327
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