Vitas-M small molecule compound
ethyl 3-cyano-2-({2-[(3,4-dimethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-5,6,7,8-tetrahydroquinoline-4-carboxylate
Catalog ID
STK842468
SMILES CCOC(=O)c1c(C#N)c(SCC(=O)Nc2ccc(c(c2)OC)OC)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 C23H25N3O5S MW 455.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O5S/c1-4-31-23(28)21-15-7-5-6-8-17(15)26-22(16(21)12-24)32-13-20(27)25-14-9-10-18(29-2)19(11-14)30-3/h9-11H,4-8,13H2,1-3H3,(H,25,27)InChIKey
KLUGOKKCGUFQFI-UHFFFAOYSA-NSynonyms
445383-69-7445383697
CCOC(=O)C1=C(C(=NC2=C1CCCC2)SCC(=O)NC3=CC(=C(C=C3)OC)OC)C#N
ethyl3cyano2((2((34dimethoxyphenyl)amino)2oxoethyl)sulfanyl)5678tetrahydroquinoline4carboxylate
ethyl3cyano2((2((34dimethoxyphenyl)amino)2oxoethyl)thio)5678tetrahydroquinoline4carboxylate
ethyl3cyano2(2(34dimethoxyanilino)2oxoethyl)sulfanyl5678tetrahydroquinoline4carboxylate
InChI=1SC23H25N3O5Sc143123(28)2115756817(15)2622(16(21)1224)321320(27)251491018(292)19(1114)303h911H4813H213H3(H2527)
MFCD03234615
ZINC000000803977
ZINC00803977
ZINC803977
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