Vitas-M small molecule compound
ethyl 4-(3,4-difluorophenyl)-6-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL107572
SMILES CCOC(=O)C1=C(CN2CCC3(CC2)OCCO3)NC(=O)NC1c1ccc(c(c1)F)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 C21H25F2N3O5 MW 437.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25F2N3O5/c1-2-29-19(27)17-16(12-26-7-5-21(6-8-26)30-9-10-31-21)24-20(28)25-18(17)13-3-4-14(22)15(23)11-13/h3-4,11,18H,2,5-10,12H2,1H3,(H2,24,25,28)InChIKey
ZFBVVBZKOFRBAK-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC(=C(C=C2)F)F)CN3CCC4(CC3)OCCO4
ethyl4(34difluorophenyl)6(14dioxa8azaspiro(45)dec8ylmethyl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl4(34difluorophenyl)6(14dioxa8azaspiro(45)decan8ylmethyl)2oxo34dihydro1Hpyrimidine5carboxylate
InChI=1SC21H25F2N3O5c122919(27)1716(12267521(6826)309103121)2420(28)2518(17)133414(22)15(23)1113h341118H251012H21H3(H2242528)
MFCD20741508
ZINC000067285955
ZINC000067285957
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