Vitas-M small molecule compound
3-{[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-N-methyl-N-[(1-methyl-1H-pyrazol-4-yl)methyl]propanamide
Catalog ID
STK340207
SMILES COc1ccc(cc1)c1nc(SCCC(=O)N(Cc2cnn(c2)C)C)nc(c1)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 C21H22F3N5O2S MW 465.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22F3N5O2S/c1-28(12-14-11-25-29(2)13-14)19(30)8-9-32-20-26-17(10-18(27-20)21(22,23)24)15-4-6-16(31-3)7-5-15/h4-7,10-11,13H,8-9,12H2,1-3H3InChIKey
KMBOFMIXRWPFRT-UHFFFAOYSA-NSynonyms
493019-10-63((4(4methoxyphenyl)6(trifluoromethyl)pyrimidin2yl)sulfanyl)NmethylN((1methyl1Hpyrazol4yl)methyl)propanamide
3(4(4methoxyphenyl)6(trifluoromethyl)pyrimidin2yl)sulfanylNmethylN((1methylpyrazol4yl)methyl)propanamide
3(4(4METHOXYPHENYL)6(TRIFLUOROMETHYL)PYRIMIDIN2YLTHIO)NMETHYLN((1METHYLPYRAZOL4YL)METHYL)PROPANAMIDE
493019106
CN1C=C(C=N1)CN(C)C(=O)CCSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)OC
InChI=1SC21H22F3N5O2Sc128(1214112529(2)1314)19(30)8932202617(1018(2720)21(2223)24)154616(313)7515h47101113H8912H213H3
MFCD03043265
ZINC000000920539
ZINC00920539
ZINC920539
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