Vitas-M small molecule compound

methyl 5-ethyl-2-({2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]butanoyl}amino)thiophene-3-carboxylate

Catalog ID
STL405545
SMILES CCC(n1nc(c2c1CCC2)C(F)(F)F)C(=O)Nc1sc(cc1C(=O)OC)CC

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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 C19H22F3N3O3S MW 429.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22F3N3O3S/c1-4-10-9-12(18(27)28-3)17(29-10)23-16(26)13(5-2)25-14-8-6-7-11(14)15(24-25)19(20,21)22/h9,13H,4-8H2,1-3H3,(H,23,26)
InChIKey
JHIVVZXKKMTOAP-UHFFFAOYSA-N
Synonyms
938019-35-3
938019353
CCC1=CC(=C(S1)NC(=O)C(CC)N2C3=C(CCC3)C(=N2)C(F)(F)F)C(=O)OC
InChI=1SC19H22F3N3O3Sc1410912(18(27)283)17(2910)2316(26)13(52)251486711(14)15(2425)19(2021)22h913H48H213H3(H2326)
methyl5ethyl2((2(3(trifluoromethyl)56dihydrocyclopenta(c)pyrazol1(4H)yl)butanoyl)amino)thiophene3carboxylate
methyl5ethyl2(2(3(trifluoromethyl)56dihydro4Hcyclopenta(c)pyrazol1yl)butanoylamino)thiophene3carboxylate
MFCD08555284
ZINC000020607573
ZINC000020607574

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Available files

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