Vitas-M small molecule compound

methyl 2-({[6-cyclopropyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]acetyl}amino)-5-methylthiophene-3-carboxylate

Catalog ID
STL396175
SMILES COC(=O)c1cc(sc1NC(=O)Cn1nc(c2c1nc(cc2C(F)(F)F)C1CC1)C)C

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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 C20H19F3N4O3S MW 452.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19F3N4O3S/c1-9-6-12(19(29)30-3)18(31-9)25-15(28)8-27-17-16(10(2)26-27)13(20(21,22)23)7-14(24-17)11-4-5-11/h6-7,11H,4-5,8H2,1-3H3,(H,25,28)
InChIKey
QHJOGNWFTJTIIW-UHFFFAOYSA-N
Synonyms
1011378-15-6
1011378156
CC1=CC(=C(S1)NC(=O)CN2C3=C(C(=N2)C)C(=CC(=N3)C4CC4)C(F)(F)F)C(=O)OC
InChI=1SC20H19F3N4O3Sc19612(19(29)303)18(319)2515(28)8271716(10(2)2627)13(20(2122)23)714(2417)114511h6711H458H213H3(H2528)
METHYL2(((6CYCLOPROPYL3METHYL4(TRIFLUOROMETHYL)1HPYRAZOLO(34B)PYRIDIN1YL)ACETYL)AMINO)5METHYLTHIOPHENE3CARBOXYLATE
methyl2((2(6cyclopropyl3methyl4(trifluoromethyl)pyrazolo(34b)pyridin1yl)acetyl)amino)5methylthiophene3carboxylate
MFCD09469768
ZINC000020602537
ZINC20602537

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Available files

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