Vitas-M small molecule compound

ethyl (6-hydroxy-2-{N''-(phenylcarbonyl)-N'-[2-(trifluoromethyl)phenyl]carbamimidamido}pyrimidin-4-yl)acetate

Catalog ID
STK569654
SMILES CCOC(=O)Cc1nc(nc(c1)O)N/C(=N/C(=O)c1ccccc1)/Nc1ccccc1C(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 C23H20F3N5O4 MW 487.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20F3N5O4/c1-2-35-19(33)13-15-12-18(32)29-21(27-15)31-22(30-20(34)14-8-4-3-5-9-14)28-17-11-7-6-10-16(17)23(24,25)26/h3-12H,2,13H2,1H3,(H3,27,28,29,30,31,32,34)
InChIKey
IAYXLQBJQZLEDO-UHFFFAOYSA-N
Synonyms
709003-04-3
709003043
CCOC(=O)CC1=CC(=O)N=C(N1)NC(=NC(=O)C2=CC=CC=C2)NC3=CC=CC=C3C(F)(F)F
CCOC(=O)Cc1nc(nc(c1)O)NC(=NC(=O)c1ccccc1)Nc1ccccc1C(F)(F)F
ETHYL(2(((BENZOYLIMINO)((2(TRIFLUOROMETHYL)PHENYL)AMINO)METHYL)AMINO)6OXO16DIHYDRO4PYRIMIDINYL)ACETATE
ethyl(6hydroxy2(N(phenylcarbonyl)N(2(trifluoromethyl)phenyl)carbamimidamido)pyrimidin4yl)acetate
ETHYL2(2(((1E)3OXO3PHENYL1((2(TRIFLUOROMETHYL)PHENYL)AMINO)2AZAPROP1ENYL)AMINO)6OXOHYDROPYRIMIDIN4YL)ACETATE
ETHYL2(2((NBENZOYLN(2(TRIFLUOROMETHYL)PHENYL)CARBAMIMIDOYL)AMINO)4OXO1HPYRIMIDIN6YL)ACETATE
InChI=1SC23H20F3N5O4c123519(33)13151218(32)2921(2715)3122(3020(34)148435914)281711761016(17)23(2425)26h312H213H21H3(H327282930313234)
MFCD05728593
ZINC000018179543
ZINC18179543

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Available files

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