Vitas-M small molecule compound
3-(4-fluorophenyl)-3-hydroxy-7-(4-hydroxy-3-methoxyphenyl)-5-oxo-2,3,6,7-tetrahydro-5H-[1,3]thiazolo[3,2-a]pyridine-8-carbonitrile
Catalog ID
STK886777
SMILES N#CC1=C2SCC(N2C(=O)CC1c1ccc(c(c1)OC)O)(O)c1ccc(cc1)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 C21H17FN2O4S MW 412.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17FN2O4S/c1-28-18-8-12(2-7-17(18)25)15-9-19(26)24-20(16(15)10-23)29-11-21(24,27)13-3-5-14(22)6-4-13/h2-8,15,25,27H,9,11H2,1H3InChIKey
IWICKLBRYYZFFV-UHFFFAOYSA-NSynonyms
3(4fluorophenyl)3hydroxy7(4hydroxy3methoxyphenyl)5oxo2367tetrahydro5H(13)thiazolo(32a)pyridine8carbonitrile
3(4fluorophenyl)3hydroxy7(4hydroxy3methoxyphenyl)5oxo67dihydro2H(13)thiazolo(32a)pyridine8carbonitrile
COC1=C(C=CC(=C1)C2CC(=O)N3C(=C2C#N)SCC3(C4=CC=C(C=C4)F)O)O
InChI=1SC21H17FN2O4Sc12818812(2717(18)25)15919(26)2420(16(15)1023)291121(2427)133514(22)6413h28152527H911H21H3
MFCD10087351
ZINC000012276125
ZINC000012276133
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