Vitas-M small molecule compound
[4-hydroxy-6-(thiophen-2-yl)-2-thioxo-4-(trifluoromethyl)hexahydropyrimidin-5-yl](thiophen-2-yl)methanone
Catalog ID
STL091069
SMILES S=C1NC(c2cccs2)C(C(N1)(O)C(F)(F)F)C(=O)c1cccs1
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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 C14H11F3N2O2S3 MW 392.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11F3N2O2S3/c15-14(16,17)13(21)9(11(20)8-4-2-6-24-8)10(18-12(22)19-13)7-3-1-5-23-7/h1-6,9-10,21H,(H2,18,19,22)InChIKey
XMMPUZPGAPNETH-UHFFFAOYSA-NSynonyms
((4R5S6S)4HYDROXY6(THIOPHEN2YL)2THIOXO4(TRIFLUOROMETHYL)HEXAHYDROPYRIMIDIN5YL)(THIOPHEN2YL)METHANONE
(4HYDROXY2SULFANYLIDENE6THIOPHEN2YL4(TRIFLUOROMETHYL)13DIAZINAN5YL)THIOPHEN2YLMETHANONE
(4hydroxy6(thiophen2yl)2thioxo4(trifluoromethyl)hexahydropyrimidin5yl)(thiophen2yl)methanone
C1=CSC(=C1)C2C(C(NC(=S)N2)(C(F)(F)F)O)C(=O)C3=CC=CS3
InChI=1SC14H11F3N2O2S3c1514(1617)13(21)9(11(20)8426248)10(1812(22)1913)7315237h1691021H(H2181922)
MFCD02331006
ZINC000001314446
ZINC000102140594
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