Vitas-M small molecule compound
2-{[3-cyano-7,7-dimethyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide
Catalog ID
STK839109
SMILES N#CC1=C(SCC(=O)Nc2cccc(c2C)C)NC2=C(C1c1cccs1)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 C26H27N3O2S2 MW 477.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O2S2/c1-15-7-5-8-18(16(15)2)28-22(31)14-33-25-17(13-27)23(21-9-6-10-32-21)24-19(29-25)11-26(3,4)12-20(24)30/h5-10,23,29H,11-12,14H2,1-4H3,(H,28,31)InChIKey
FHJWGCILRMMESC-UHFFFAOYSA-NSynonyms
374914-76-82((3cyano77dimethyl5oxo4(thiophen2yl)145678hexahydroquinolin2yl)sulfanyl)N(23dimethylphenyl)acetamide
2((3cyano77dimethyl5oxo4(thiophen2yl)145678hexahydroquinolin2yl)thio)N(23dimethylphenyl)acetamide
2((3cyano77dimethyl5oxo4thiophen2yl1468tetrahydroquinolin2yl)sulfanyl)N(23dimethylphenyl)acetamide
374914768
CC1=C(C(=CC=C1)NC(=O)CSC2=C(C(C3=C(N2)CC(CC3=O)(C)C)C4=CC=CS4)C#N)C
InChI=1SC26H27N3O2S2c11575818(16(15)2)2822(31)14332517(1327)23(2196103221)2419(2925)1126(34)1220(24)30h5102329H111214H214H3(H2831)
MFCD02236102
ZINC000013080565
ZINC000013080566
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