Vitas-M small molecule compound

2-ethyl 4-methyl 5-({[3,5-bis(difluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-3-methylthiophene-2,4-dicarboxylate

Catalog ID
STK956030
SMILES CCOC(=O)c1sc(c(c1C)C(=O)OC)NC(=O)Cn1nc(cc1C(F)F)C(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 C17H17F4N3O5S MW 451.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17F4N3O5S/c1-4-29-17(27)12-7(2)11(16(26)28-3)15(30-12)22-10(25)6-24-9(14(20)21)5-8(23-24)13(18)19/h5,13-14H,4,6H2,1-3H3,(H,22,25)
InChIKey
SBNIFALQAIWIPG-UHFFFAOYSA-N
Synonyms
512808-63-8
2ETHYL4METHYL5(((35BIS(DIFLUOROMETHYL)1HPYRAZOL1YL)ACETYL)AMINO)3METHYL24THIOPHENEDICARBOXYLATE
2ethyl4methyl5(((35bis(difluoromethyl)1Hpyrazol1yl)acetyl)amino)3methylthiophene24dicarboxylate
2OETHYL4OMETHYL5((2(35BIS(DIFLUOROMETHYL)PYRAZOL1YL)ACETYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
512808638
CCOC(=O)C1=C(C(=C(S1)NC(=O)CN2C(=CC(=N2)C(F)F)C(F)F)C(=O)OC)C
InChI=1SC17H17F4N3O5Sc142917(27)127(2)11(16(26)283)15(3012)2210(25)6249(14(20)21)58(2324)13(18)19h51314H46H213H3(H2225)
MFCD03465512
ZINC000000650546
ZINC00650546
ZINC650546

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Available files

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