Vitas-M small molecule compound
propan-2-yl ({4-[3-(benzyloxy)-4-methoxyphenyl]-3-cyano-6-oxo-1,4,5,6-tetrahydropyridin-2-yl}sulfanyl)acetate
Catalog ID
STK806071
SMILES N#CC1=C(SCC(=O)OC(C)C)NC(=O)CC1c1ccc(c(c1)OCc1ccccc1)OC
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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 C25H26N2O5S MW 466.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O5S/c1-16(2)32-24(29)15-33-25-20(13-26)19(12-23(28)27-25)18-9-10-21(30-3)22(11-18)31-14-17-7-5-4-6-8-17/h4-11,16,19H,12,14-15H2,1-3H3,(H,27,28)InChIKey
AKHYSDJSBWBPMC-UHFFFAOYSA-NSynonyms
310454-20-7310454207
CC(C)OC(=O)CSC1=C(C(CC(=O)N1)C2=CC(=C(C=C2)OC)OCC3=CC=CC=C3)C#N
InChI=1SC25H26N2O5Sc116(2)3224(29)15332520(1326)19(1223(28)2725)1891021(303)22(1118)3114177546817h4111619H121415H213H3(H2728)
isopropyl2((4(3(benzyloxy)4methoxyphenyl)3cyano6oxo1456tetrahydropyridin2yl)thio)acetate
MFCD01578965
propan2yl((4(3(benzyloxy)4methoxyphenyl)3cyano6oxo1456tetrahydropyridin2yl)sulfanyl)acetate
PROPAN2YL2((5CYANO4(4METHOXY3PHENYLMETHOXYPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)ACETATE
ZINC000009109745
ZINC000009110088
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