Vitas-M small molecule compound
methyl {[3-cyano-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetate
Catalog ID
STK527146
SMILES COC(=O)CSc1nc2CCCCc2c(c1C#N)c1cccs1
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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 C17H16N2O2S2 MW 344.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O2S2/c1-21-15(20)10-23-17-12(9-18)16(14-7-4-8-22-14)11-5-2-3-6-13(11)19-17/h4,7-8H,2-3,5-6,10H2,1H3InChIKey
CGNLDABFXHAVLA-UHFFFAOYSA-NSynonyms
210766-84-0210766840
COC(=O)CSC1=NC2=C(CCCC2)C(=C1C#N)C3=CC=CS3
InChI=1SC17H16N2O2S2c12115(20)10231712(918)16(147482214)11523613(11)1917h478H235610H21H3
methyl((3cyano4(thiophen2yl)5678tetrahydroquinolin2yl)sulfanyl)acetate
methyl2((3cyano4(thiophen2yl)5678tetrahydroquinolin2yl)thio)acetate
methyl2((3cyano4thiophen2yl5678tetrahydroquinolin2yl)sulfanyl)acetate
MFCD00395593
ZINC000000500749
ZINC00500749
ZINC500749
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