Vitas-M small molecule compound

1-({[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-(3,4,5-trimethoxyphenyl)-1H-pyrazole-3-carboxamide

Catalog ID
STK305989
SMILES COc1c(OC)cc(cc1OC)NC(=O)c1ccn(n1)CSc1nc(C)cc(n1)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 C20H20F3N5O4S MW 483.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20F3N5O4S/c1-11-7-16(20(21,22)23)26-19(24-11)33-10-28-6-5-13(27-28)18(29)25-12-8-14(30-2)17(32-4)15(9-12)31-3/h5-9H,10H2,1-4H3,(H,25,29)
InChIKey
ZQZNIPOTCOHXBK-UHFFFAOYSA-N
Synonyms
1005582-82-0
(1((4METHYL6(TRIFLUOROMETHYL)PYRIMIDIN2YLTHIO)METHYL)PYRAZOL3YL)N(345TRIMETHOXYPHENYL)CARBOXAMIDE
1(((4methyl6(trifluoromethyl)pyrimidin2yl)sulfanyl)methyl)N(345trimethoxyphenyl)1Hpyrazole3carboxamide
1((4METHYL6(TRIFLUOROMETHYL)PYRIMIDIN2YL)SULFANYLMETHYL)N(345TRIMETHOXYPHENYL)PYRAZOLE3CARBOXAMIDE
1005582820
CC1=CC(=NC(=N1)SCN2C=CC(=N2)C(=O)NC3=CC(=C(C(=C3)OC)OC)OC)C(F)(F)F
InChI=1SC20H20F3N5O4Sc111716(20(2122)23)2619(2411)3310286513(2728)18(29)2512814(302)17(324)15(912)313h59H10H214H3(H2529)
MFCD04046255
ZINC000002788148
ZINC02788148
ZINC2788148

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Available files

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