Vitas-M small molecule compound
2-({4-[4-(benzyloxy)phenyl]-3-cyano-6-oxo-1,4,5,6-tetrahydropyridin-2-yl}sulfanyl)-N-(4-fluorophenyl)acetamide
Catalog ID
STK842123
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)F)NC(=O)CC1c1ccc(cc1)OCc1ccccc1
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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 C27H22FN3O3S MW 487.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22FN3O3S/c28-20-8-10-21(11-9-20)30-26(33)17-35-27-24(15-29)23(14-25(32)31-27)19-6-12-22(13-7-19)34-16-18-4-2-1-3-5-18/h1-13,23H,14,16-17H2,(H,30,33)(H,31,32)InChIKey
OCPPIDQTFDKGKK-UHFFFAOYSA-NSynonyms
500106-23-02((4(4(benzyloxy)phenyl)3cyano6oxo1456tetrahydropyridin2yl)sulfanyl)N(4fluorophenyl)acetamide
2((4(4(benzyloxy)phenyl)3cyano6oxo1456tetrahydropyridin2yl)thio)N(4fluorophenyl)acetamide
2((5CYANO2OXO4(4PHENYLMETHOXYPHENYL)34DIHYDRO1HPYRIDIN6YL)SULFANYL)N(4FLUOROPHENYL)ACETAMIDE
500106230
C1C(C(=C(NC1=O)SCC(=O)NC2=CC=C(C=C2)F)C#N)C3=CC=C(C=C3)OCC4=CC=CC=C4
InChI=1SC27H22FN3O3Sc282081021(11920)3026(33)17352724(1529)23(1425(32)3127)1961222(13719)3416184213518h11323H141617H2(H3033)(H3132)
MFCD03304212
ZINC000009089108
ZINC000009089109
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