Vitas-M small molecule compound
methyl 5-amino-6-cyano-2-methyl-7-[4-(trifluoromethyl)phenyl]-7H-thieno[3,2-b]pyran-3-carboxylate
Catalog ID
STK778427
SMILES COC(=O)c1c(C)sc2c1OC(=C(C2c1ccc(cc1)C(F)(F)F)C#N)N
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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 C18H13F3N2O3S MW 394.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13F3N2O3S/c1-8-12(17(24)25-2)14-15(27-8)13(11(7-22)16(23)26-14)9-3-5-10(6-4-9)18(19,20)21/h3-6,13H,23H2,1-2H3InChIKey
WBQDNTZKWHRCKC-UHFFFAOYSA-NSynonyms
CC1=C(C2=C(S1)C(C(=C(O2)N)C#N)C3=CC=C(C=C3)C(F)(F)F)C(=O)OC
InChI=1SC18H13F3N2O3Sc1812(17(24)252)1415(278)13(11(722)16(23)2614)93510(649)18(1920)21h3613H23H212H3
METHYL(7R)5AMINO6CYANO2METHYL7(4(TRIFLUOROMETHYL)PHENYL)7HTHIENO(32B)PYRAN3CARBOXYLATE
METHYL(7S)5AMINO6CYANO2METHYL7(4(TRIFLUOROMETHYL)PHENYL)7HTHIENO(32B)PYRAN3CARBOXYLATE
methyl5amino6cyano2methyl7(4(trifluoromethyl)phenyl)7Hthieno(32b)pyran3carboxylate
MFCD05856610
ZINC000001427418
ZINC000001427419
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