Vitas-M small molecule compound
methyl 4-carbamoyl-5-({[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-3-methylthiophene-2-carboxylate
Catalog ID
STL396594
SMILES COC(=O)c1sc(c(c1C)C(=O)N)NC(=O)Cn1nc(cc1C1CC1)C(F)(F)F
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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 C17H17F3N4O4S MW 430.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17F3N4O4S/c1-7-12(14(21)26)15(29-13(7)16(27)28-2)22-11(25)6-24-9(8-3-4-8)5-10(23-24)17(18,19)20/h5,8H,3-4,6H2,1-2H3,(H2,21,26)(H,22,25)InChIKey
PBCUINCFWJLNRW-UHFFFAOYSA-NSynonyms
1005558-28-01005558280
CC1=C(SC(=C1C(=O)N)NC(=O)CN2C(=CC(=N2)C(F)(F)F)C3CC3)C(=O)OC
InChI=1SC17H17F3N4O4Sc1712(14(21)26)15(2913(7)16(27)282)2211(25)6249(8348)510(2324)17(1819)20h58H346H212H3(H22126)(H2225)
METHYL4CARBAMOYL5(((5CYCLOPROPYL3(TRIFLUOROMETHYL)1HPYRAZOL1YL)ACETYL)AMINO)3METHYLTHIOPHENE2CARBOXYLATE
METHYL4CARBAMOYL5((2(5CYCLOPROPYL3(TRIFLUOROMETHYL)PYRAZOL1YL)ACETYL)AMINO)3METHYLTHIOPHENE2CARBOXYLATE
MFCD04048623
ZINC000002752099
ZINC02752099
ZINC2752099
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