Vitas-M small molecule compound
N-{1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}furan-2-carboxamide
Catalog ID
STK773907
SMILES COc1cc(ccc1OC)CCn1c(=O)[nH]c(=O)c2c1NC(=O)C2(NC(=O)c1ccco1)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 C22H19F3N4O7 MW 508.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19F3N4O7/c1-34-12-6-5-11(10-14(12)35-2)7-8-29-16-15(18(31)27-20(29)33)21(19(32)26-16,22(23,24)25)28-17(30)13-4-3-9-36-13/h3-6,9-10H,7-8H2,1-2H3,(H,26,32)(H,28,30)(H,27,31,33)InChIKey
XYBDMVXFQAWRIO-UHFFFAOYSA-NSynonyms
606924-15-6COC1=C(C=C(C=C1)CCN2C3=C(C(=O)NC2=O)C(C(=O)N3)(C(F)(F)F)NC(=O)C4=CC=CO4)OC
COc1cc(ccc1OC)CCn1c(=O)(nH)c(=O)c2c1NC(=O)C2(NC(=O)c1ccco1)C(F)(F)F
InChI=1SC22H19F3N4O7c134126511(1014(12)352)78291615(18(31)2720(29)33)21(19(32)261622(2324)25)2817(30)134393613h36910H78H212H3(H2632)(H2830)(H273133)
MFCD03855826
N(1(2(34dimethoxyphenyl)ethyl)246trioxo5(trifluoromethyl)234567hexahydro1Hpyrrolo(23d)pyrimidin5yl)furan2carboxamide
N(1(2(34DIMETHOXYPHENYL)ETHYL)246TRIOXO5(TRIFLUOROMETHYL)7HPYRROLO(23D)PYRIMIDIN5YL)FURAN2CARBOXAMIDE
N(1(34dimethoxyphenethyl)246trioxo5(trifluoromethyl)234567hexahydro1Hpyrrolo(23d)pyrimidin5yl)furan2carboxamide
ZINC000001868344
ZINC000001868345
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.