Vitas-M small molecule compound
3-chloro-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
STK770481
SMILES COc1ccc(cc1)n1c(=O)[nH]c(=O)c2c1NC(=O)C2(NC(=O)c1cccc(c1)Cl)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 C21H14ClF3N4O5 MW 494.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14ClF3N4O5/c1-34-13-7-5-12(6-8-13)29-15-14(17(31)27-19(29)33)20(18(32)26-15,21(23,24)25)28-16(30)10-3-2-4-11(22)9-10/h2-9H,1H3,(H,26,32)(H,28,30)(H,27,31,33)InChIKey
VQCXVORYVHJOLU-UHFFFAOYSA-NSynonyms
606923-85-73chloroN(1(4methoxyphenyl)246trioxo5(trifluoromethyl)234567hexahydro1Hpyrrolo(23d)pyrimidin5yl)benzamide
3CHLORON(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=C4)Cl
COc1ccc(cc1)n1c(=O)(nH)c(=O)c2c1NC(=O)C2(NC(=O)c1cccc(c1)Cl)C(F)(F)F
InChI=1SC21H14ClF3N4O5c134137512(6813)291514(17(31)2719(29)33)20(18(32)261521(2324)25)2816(30)1032411(22)910h29H1H3(H2632)(H2830)(H273133)
MFCD03766212
ZINC000002264693
ZINC000002264694
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