Vitas-M small molecule compound
methyl 6-({2-[(2-methoxy-5-methylphenyl)amino]-2-oxoethyl}sulfanyl)-3-[(trifluoroacetyl)amino]-1-benzothiophene-2-carboxylate
Catalog ID
STK688254
SMILES COC(=O)c1sc2c(c1NC(=O)C(F)(F)F)ccc(c2)SCC(=O)Nc1cc(C)ccc1OC
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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 C22H19F3N2O5S2 MW 512.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19F3N2O5S2/c1-11-4-7-15(31-2)14(8-11)26-17(28)10-33-12-5-6-13-16(9-12)34-19(20(29)32-3)18(13)27-21(30)22(23,24)25/h4-9H,10H2,1-3H3,(H,26,28)(H,27,30)InChIKey
BKCSZYQCTSNDDR-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)OC)NC(=O)CSC2=CC3=C(C=C2)C(=C(S3)C(=O)OC)NC(=O)C(F)(F)F
InChI=1SC22H19F3N2O5S2c1114715(312)14(811)2617(28)103312561316(912)3419(20(29)323)18(13)2721(30)22(2324)25h49H10H213H3(H2628)(H2730)
methyl6((2((2methoxy5methylphenyl)amino)2oxoethyl)sulfanyl)3((trifluoroacetyl)amino)1benzothiophene2carboxylate
METHYL6(2(2METHOXY5METHYLANILINO)2OXOETHYL)SULFANYL3((222TRIFLUOROACETYL)AMINO)1BENZOTHIOPHENE2CARBOXYLATE
MFCD07657152
ZINC000015023105
ZINC15023105
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