Vitas-M small molecule compound
6-chloro-4-(2-fluorophenyl)-7-hydroxy-6',6'-dimethyl-3,4,5',6'-tetrahydro-1'H-spiro[chromene-2,4'-pyrimidine]-2'(3'H)-thione
Catalog ID
STK773969
SMILES S=C1NC(C)(C)CC2(N1)Oc1cc(O)c(cc1C(C2)c1ccccc1F)Cl
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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 C20H20ClFN2O2S MW 406.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClFN2O2S/c1-19(2)10-20(24-18(27)23-19)9-13(11-5-3-4-6-15(11)22)12-7-14(21)16(25)8-17(12)26-20/h3-8,13,25H,9-10H2,1-2H3,(H2,23,24,27)InChIKey
LDMMFURXYJLEFT-UHFFFAOYSA-NSynonyms
6chloro4(2fluorophenyl)7hydroxy44dimethylspiro(13diazinane6234dihydrochromene)2thione
6CHLORO4(2FLUOROPHENYL)7HYDROXY44DIMETHYLSPIRO(CHROMAN26HEXAHYDROPYRIMIDINE)2THIONE
6chloro4(2fluorophenyl)7hydroxy66dimethyl3456tetrahydro1Hspiro(chromene24pyrimidine)2(3H)thione
CC1(CC2(CC(C3=CC(=C(C=C3O2)O)Cl)C4=CC=CC=C4F)NC(=S)N1)C
InChI=1SC20H20ClFN2O2Sc119(2)1020(2418(27)2319)913(11534615(11)22)12714(21)16(25)817(12)2620h381325H910H212H3(H2232427)
MFCD03700458
ZINC000013521686
ZINC000013521697
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