Vitas-M small molecule compound
2-{[4-(4-chlorophenyl)-3-cyano-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide
Catalog ID
STK891719
SMILES N#CC1=C(SCC(=O)Nc2c(C)cc(cc2C)C)NC(=O)CC1c1ccc(cc1)Cl
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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 C23H22ClN3O2S MW 439.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN3O2S/c1-13-8-14(2)22(15(3)9-13)26-21(29)12-30-23-19(11-25)18(10-20(28)27-23)16-4-6-17(24)7-5-16/h4-9,18H,10,12H2,1-3H3,(H,26,29)(H,27,28)InChIKey
HFCBKWDOEACOCK-UHFFFAOYSA-NSynonyms
2((4(4chlorophenyl)3cyano6oxo1456tetrahydropyridin2yl)sulfanyl)N(246trimethylphenyl)acetamide
2((4(4chlorophenyl)5cyano2oxo34dihydro1Hpyridin6yl)sulfanyl)N(246trimethylphenyl)acetamide
CC1=CC(=C(C(=C1)C)NC(=O)CSC2=C(C(CC(=O)N2)C3=CC=C(C=C3)Cl)C#N)C
InChI=1SC23H22ClN3O2Sc113814(2)22(15(3)913)2621(29)12302319(1125)18(1020(28)2723)164617(24)7516h4918H1012H213H3(H2629)(H2728)
MFCD04397299
ZINC000012250030
ZINC000012250031
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