Vitas-M small molecule compound
2-{[4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide
Catalog ID
STK538092
SMILES N#CC1=C(SCC(=O)Nc2cccc(c2C)C)NC2=C(C1c1ccc(cc1)Cl)C(=O)CC(C2)(C)C
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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 C28H28ClN3O2S MW 506.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28ClN3O2S/c1-16-6-5-7-21(17(16)2)31-24(34)15-35-27-20(14-30)25(18-8-10-19(29)11-9-18)26-22(32-27)12-28(3,4)13-23(26)33/h5-11,25,32H,12-13,15H2,1-4H3,(H,31,34)InChIKey
AJFKLMYAGFHYQW-UHFFFAOYSA-NSynonyms
370849-38-02((4(4chlorophenyl)3cyano77dimethyl5oxo145678hexahydroquinolin2yl)sulfanyl)N(23dimethylphenyl)acetamide
2((4(4chlorophenyl)3cyano77dimethyl5oxo145678hexahydroquinolin2yl)thio)N(23dimethylphenyl)acetamide
2((4(4chlorophenyl)3cyano77dimethyl5oxo1468tetrahydroquinolin2yl)sulfanyl)N(23dimethylphenyl)acetamide
370849380
CC1=C(C(=CC=C1)NC(=O)CSC2=C(C(C3=C(N2)CC(CC3=O)(C)C)C4=CC=C(C=C4)Cl)C#N)C
InChI=1SC28H28ClN3O2Sc11665721(17(16)2)3124(34)15352720(1430)25(1881019(29)11918)2622(3227)1228(34)1323(26)33h5112532H121315H214H3(H3134)
MFCD02999484
ZINC000013174263
ZINC000013174383
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