Vitas-M small molecule compound
7-(3-ethoxy-4-propoxyphenyl)-3-(4-fluorophenyl)-3-hydroxy-5-oxo-2,3,6,7-tetrahydro-5H-[1,3]thiazolo[3,2-a]pyridine-8-carbonitrile
Catalog ID
STK886755
SMILES CCCOc1ccc(cc1OCC)C1CC(=O)N2C(=C1C#N)SCC2(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 C25H25FN2O4S MW 468.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25FN2O4S/c1-3-11-32-21-10-5-16(12-22(21)31-4-2)19-13-23(29)28-24(20(19)14-27)33-15-25(28,30)17-6-8-18(26)9-7-17/h5-10,12,19,30H,3-4,11,13,15H2,1-2H3InChIKey
BBBUTUJKLPNVQU-UHFFFAOYSA-NSynonyms
7(3ethoxy4propoxyphenyl)3(4fluorophenyl)3hydroxy5oxo2367tetrahydro5H(13)thiazolo(32a)pyridine8carbonitrile
7(3ethoxy4propoxyphenyl)3(4fluorophenyl)3hydroxy5oxo67dihydro2H(13)thiazolo(32a)pyridine8carbonitrile
CCCOC1=C(C=C(C=C1)C2CC(=O)N3C(=C2C#N)SCC3(C4=CC=C(C=C4)F)O)OCC
InChI=1SC25H25FN2O4Sc1311322110516(1222(21)3142)191323(29)2824(20(19)1427)331525(2830)176818(26)9717h510121930H34111315H212H3
MFCD10087302
ZINC000012275615
ZINC000012275621
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