Vitas-M small molecule compound
3-hydroxy-3-(3-methoxyphenyl)-7-(4-methylphenyl)-5-oxo-2,3,6,7-tetrahydro-5H-[1,3]thiazolo[3,2-a]pyridine-8-carbonitrile
Catalog ID
STK886736
SMILES COc1cccc(c1)C1(O)CSC2=C(C(CC(=O)N12)c1ccc(cc1)C)C#N
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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 C22H20N2O3S MW 392.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O3S/c1-14-6-8-15(9-7-14)18-11-20(25)24-21(19(18)12-23)28-13-22(24,26)16-4-3-5-17(10-16)27-2/h3-10,18,26H,11,13H2,1-2H3InChIKey
IOAUFNILLCATQA-UHFFFAOYSA-NSynonyms
3hydroxy3(3methoxyphenyl)7(4methylphenyl)5oxo2367tetrahydro5H(13)thiazolo(32a)pyridine8carbonitrile
3hydroxy3(3methoxyphenyl)7(4methylphenyl)5oxo67dihydro2H(13)thiazolo(32a)pyridine8carbonitrile
CC1=CC=C(C=C1)C2CC(=O)N3C(=C2C#N)SCC3(C4=CC(=CC=C4)OC)O
InChI=1SC22H20N2O3Sc1146815(9714)181120(25)2421(19(18)1223)281322(2426)1643517(1016)272h3101826H1113H212H3
MFCD10087266
ZINC000012275321
ZINC000012275326
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