Vitas-M small molecule compound
methyl 6-({2-oxo-2-[(3,4,5-trimethoxyphenyl)amino]ethyl}sulfanyl)-3-[(trifluoroacetyl)amino]-1-benzothiophene-2-carboxylate
Catalog ID
STK688237
SMILES COC(=O)c1sc2c(c1NC(=O)C(F)(F)F)ccc(c2)SCC(=O)Nc1cc(OC)c(c(c1)OC)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 C23H21F3N2O7S2 MW 558.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21F3N2O7S2/c1-32-14-7-11(8-15(33-2)19(14)34-3)27-17(29)10-36-12-5-6-13-16(9-12)37-20(21(30)35-4)18(13)28-22(31)23(24,25)26/h5-9H,10H2,1-4H3,(H,27,29)(H,28,31)InChIKey
HAUKVXGIUJBLAO-UHFFFAOYSA-NSynonyms
COC1=CC(=CC(=C1OC)OC)NC(=O)CSC2=CC3=C(C=C2)C(=C(S3)C(=O)OC)NC(=O)C(F)(F)F
InChI=1SC23H21F3N2O7S2c13214711(815(332)19(14)343)2717(29)103612561316(912)3720(21(30)354)18(13)2822(31)23(2425)26h59H10H214H3(H2729)(H2831)
methyl6((2oxo2((345trimethoxyphenyl)amino)ethyl)sulfanyl)3((trifluoroacetyl)amino)1benzothiophene2carboxylate
METHYL6(2OXO2(345TRIMETHOXYANILINO)ETHYL)SULFANYL3((222TRIFLUOROACETYL)AMINO)1BENZOTHIOPHENE2CARBOXYLATE
MFCD07657127
ZINC000098008935
ZINC98008935
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