Vitas-M small molecule compound
ethyl 2-[(4-tert-butylbenzyl)sulfanyl]-3-cyano-5,6,7,8-tetrahydroquinoline-4-carboxylate
Catalog ID
STK700603
SMILES CCOC(=O)c1c(C#N)c(SCc2ccc(cc2)C(C)(C)C)nc2c1CCCC2
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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 C24H28N2O2S MW 408.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O2S/c1-5-28-23(27)21-18-8-6-7-9-20(18)26-22(19(21)14-25)29-15-16-10-12-17(13-11-16)24(2,3)4/h10-13H,5-9,15H2,1-4H3InChIKey
NDTKSYJKHKJPDX-UHFFFAOYSA-NSynonyms
327168-42-3327168423
CCOC(=O)C1=C(C(=NC2=C1CCCC2)SCC3=CC=C(C=C3)C(C)(C)C)C#N
ethyl2((4(tertbutyl)benzyl)thio)3cyano5678tetrahydroquinoline4carboxylate
ethyl2((4tertbutylbenzyl)sulfanyl)3cyano5678tetrahydroquinoline4carboxylate
ethyl2((4tertbutylphenyl)methylsulfanyl)3cyano5678tetrahydroquinoline4carboxylate
InChI=1SC24H28N2O2Sc152823(27)2118867920(18)2622(19(21)1425)291516101217(131116)24(23)4h1013H5915H214H3
MFCD01557779
ZINC000002197153
ZINC02197153
ZINC2197153
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Check stock on Vitas-MAvailable files
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