Vitas-M small molecule compound

2-fluoro-N-[1-(4-methylphenyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide

Catalog ID
STK770423
SMILES Cc1ccc(cc1)n1c(=O)[nH]c(=O)c2c1NC(=O)C2(NC(=O)c1ccccc1F)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 C21H14F4N4O4 MW 462.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14F4N4O4/c1-10-6-8-11(9-7-10)29-15-14(17(31)27-19(29)33)20(18(32)26-15,21(23,24)25)28-16(30)12-4-2-3-5-13(12)22/h2-9H,1H3,(H,26,32)(H,28,30)(H,27,31,33)
InChIKey
HMJUYXXHXILVCX-UHFFFAOYSA-N
Synonyms
578699-00-0
2fluoroN(1(4methylphenyl)246trioxo5(trifluoromethyl)234567hexahydro1Hpyrrolo(23d)pyrimidin5yl)benzamide
2FLUORON(1(4METHYLPHENYL)246TRIOXO5(TRIFLUOROMETHYL)7HPYRROLO(23D)PYRIMIDIN5YL)BENZAMIDE
2fluoroN(246trioxo1(ptolyl)5(trifluoromethyl)234567hexahydro1Hpyrrolo(23d)pyrimidin5yl)benzamide
CC1=CC=C(C=C1)N2C3=C(C(=O)NC2=O)C(C(=O)N3)(C(F)(F)F)NC(=O)C4=CC=CC=C4F
Cc1ccc(cc1)n1c(=O)(nH)c(=O)c2c1NC(=O)C2(NC(=O)c1ccccc1F)C(F)(F)F
InChI=1SC21H14F4N4O4c1106811(9710)291514(17(31)2719(29)33)20(18(32)261521(2324)25)2816(30)12423513(12)22h29H1H3(H2632)(H2830)(H273133)
MFCD03766126
ZINC000002386556
ZINC000002386558

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Available files

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