Vitas-M small molecule compound
ethyl N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,3,3-trifluoro-2-{[(4-methoxyphenyl)carbonyl]amino}alaninate
Catalog ID
STK378003
SMILES CCOC(=O)C(C(F)(F)F)(Nc1sc2c(c1C(=O)N)CCCC2)NC(=O)c1ccc(cc1)OC
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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 C22H24F3N3O5S MW 499.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24F3N3O5S/c1-3-33-20(31)21(22(23,24)25,27-18(30)12-8-10-13(32-2)11-9-12)28-19-16(17(26)29)14-6-4-5-7-15(14)34-19/h8-11,28H,3-7H2,1-2H3,(H2,26,29)(H,27,30)InChIKey
NDDAWUSTLCTUEL-UHFFFAOYSA-NSynonyms
354530-98-6354530986
CCOC(=O)C(C(F)(F)F)(NC1=C(C2=C(S1)CCCC2)C(=O)N)NC(=O)C3=CC=C(C=C3)OC
ethyl2((3carbamoyl4567tetrahydro1benzothiophen2yl)amino)333trifluoro2((4methoxybenzoyl)amino)propanoate
ethyl2((3carbamoyl4567tetrahydrobenzo(b)thiophen2yl)amino)333trifluoro2(4methoxybenzamido)propanoate
ethylN(3carbamoyl4567tetrahydro1benzothiophen2yl)333trifluoro2(((4methoxyphenyl)carbonyl)amino)alaninate
InChI=1SC22H24F3N3O5Sc133320(31)21(22(2324)252718(30)1281013(322)11912)281916(17(26)29)14645715(14)3419h81128H37H212H3(H22629)(H2730)
MFCD01563225
ZINC000004208924
ZINC000004208926
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