Vitas-M small molecule compound

[3-cyclopropyl-5-(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl](5-ethylthiophen-3-yl)methanone

Catalog ID
STK431707
SMILES CCc1scc(c1)C(=O)N1N=C(CC1(O)C(F)F)C1CC1

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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 C14H16F2N2O2S MW 314.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16F2N2O2S/c1-2-10-5-9(7-21-10)12(19)18-14(20,13(15)16)6-11(17-18)8-3-4-8/h5,7-8,13,20H,2-4,6H2,1H3
InChIKey
MQHBGNBQHOIMHY-UHFFFAOYSA-N
Synonyms

(3cyclopropyl5(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)(5ethylthiophen3yl)methanone
(3CYCLOPROPYL5(DIFLUOROMETHYL)5HYDROXY4HPYRAZOL1YL)(5ETHYLTHIOPHEN3YL)METHANONE
5(DIFLUOROMETHYL)3CYCLOPROPYL5HYDROXY(2PYRAZOLINYL)5ETHYL(3THIENYL)KETONE
CCC1=CC(=CS1)C(=O)N2C(CC(=N2)C3CC3)(C(F)F)O
InChI=1SC14H16F2N2O2Sc121059(72110)12(19)1814(2013(15)16)611(1718)8348h5781320H246H21H3
MFCD03466481
ZINC000000204550
ZINC000000204551

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.