Vitas-M small molecule compound
diethyl [1-(4-fluorophenyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]phosphoramidate
Catalog ID
STK687399
SMILES CCOP(=O)(NC1(C(=O)Nc2c1c(=O)[nH]c(=O)n2c1ccc(cc1)F)C(F)(F)F)OCC
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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 C17H17F4N4O6P MW 480.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17F4N4O6P/c1-3-30-32(29,31-4-2)24-16(17(19,20)21)11-12(22-14(16)27)25(15(28)23-13(11)26)10-7-5-9(18)6-8-10/h5-8H,3-4H2,1-2H3,(H,22,27)(H,24,29)(H,23,26,28)InChIKey
ONHWCXYBJXLSTA-UHFFFAOYSA-NSynonyms
5(DIETHOXYPHOSPHORYLAMINO)1(4FLUOROPHENYL)5(TRIFLUOROMETHYL)7HPYRROLO(23D)PYRIMIDINE246TRIONE
CCOP(=O)(NC1(C(=O)Nc2c1c(=O)(nH)c(=O)n2c1ccc(cc1)F)C(F)(F)F)OCC
CCOP(=O)(NC1(C2=C(NC1=O)N(C(=O)NC2=O)C3=CC=C(C=C3)F)C(F)(F)F)OCC
diethyl(1(4fluorophenyl)246trioxo5(trifluoromethyl)234567hexahydro1Hpyrrolo(23d)pyrimidin5yl)phosphoramidate
InChI=1SC17H17F4N4O6Pc133032(293142)2416(17(1920)21)1112(2214(16)27)25(15(28)2313(11)26)10759(18)6810h58H34H212H3(H2227)(H2429)(H232628)
MFCD06618601
ZINC000012411271
ZINC000012411273
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