Vitas-M small molecule compound
ethyl 2-[(chloroacetyl)amino]-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-3,3,3-trifluoroalaninate
Catalog ID
STK536725
SMILES CCOC(=O)C(C(F)(F)F)(Nc1sc(c(c1C#N)CC)C)NC(=O)CCl
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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 C15H17ClF3N3O3S MW 411.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17ClF3N3O3S/c1-4-9-8(3)26-12(10(9)7-20)22-14(15(17,18)19,13(24)25-5-2)21-11(23)6-16/h22H,4-6H2,1-3H3,(H,21,23)InChIKey
JDBADFQVKPKISI-UHFFFAOYSA-NSynonyms
2(2CHLOROACETYLAMINO)2(3CYANO4ETHYL5METHYLTHIOPHEN2YLAMINO)333TRIFLUOROPROPIONICACIDETHYLESTER
CCC1=C(SC(=C1C#N)NC(C(=O)OCC)(C(F)(F)F)NC(=O)CCl)C
ETHYL2((2CHLOROACETYL)AMINO)2((3CYANO4ETHYL5METHYLTHIOPHEN2YL)AMINO)333TRIFLUOROPROPANOATE
ethyl2((chloroacetyl)amino)N(3cyano4ethyl5methylthiophen2yl)333trifluoroalaninate
ETHYL2((CHLOROACETYL)AMINO)N(3CYANO4ETHYL5METHYLTHIOPHEN2YL)333TRIFLUORODALANINATE
ethyl2(2chloroacetamido)2((3cyano4ethyl5methylthiophen2yl)amino)333trifluoropropanoate
InChI=1SC15H17ClF3N3O3Sc1498(3)2612(10(9)720)2214(15(1718)1913(24)2552)2111(23)616h22H46H213H3(H2123)
MFCD02933843
ZINC000002298370
ZINC000002298371
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