Vitas-M small molecule compound

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

Catalog ID
STK771818
SMILES COc1ccc(cc1)n1c(=O)[nH]c(=O)c2c1NC(=O)C2(NC(=O)c1ccccc1OC)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 C22H17F3N4O6 MW 490.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17F3N4O6/c1-34-12-9-7-11(8-10-12)29-16-15(18(31)27-20(29)33)21(19(32)26-16,22(23,24)25)28-17(30)13-5-3-4-6-14(13)35-2/h3-10H,1-2H3,(H,26,32)(H,28,30)(H,27,31,33)
InChIKey
DGBDBWXARNJPEK-UHFFFAOYSA-N
Synonyms

2methoxyN(1(4methoxyphenyl)246trioxo5(trifluoromethyl)234567hexahydro1Hpyrrolo(23d)pyrimidin5yl)benzamide
2METHOXYN(1(4METHOXYPHENYL)246TRIOXO5(TRIFLUOROMETHYL)7HPYRROLO(23D)PYRIMIDIN5YL)BENZAMIDE
COC1=CC=C(C=C1)N2C3=C(C(=O)NC2=O)C(C(=O)N3)(C(F)(F)F)NC(=O)C4=CC=CC=C4OC
COc1ccc(cc1)n1c(=O)(nH)c(=O)c2c1NC(=O)C2(NC(=O)c1ccccc1OC)C(F)(F)F
InChI=1SC22H17F3N4O6c134129711(81012)291615(18(31)2720(29)33)21(19(32)261622(2324)25)2817(30)13534614(13)352h310H12H3(H2632)(H2830)(H273133)
MFCD03767652
ZINC000003624309
ZINC000003624311

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Available files

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