Vitas-M small molecule compound

ethyl 4-(1,3-benzodioxol-5-yl)-2-oxo-6-(pyrrolidin-1-ylmethyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK683827
SMILES CCOC(=O)C1=C(CN2CCCC2)NC(=O)NC1c1ccc2c(c1)OCO2

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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 C19H23N3O5 MW 373.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N3O5/c1-2-25-18(23)16-13(10-22-7-3-4-8-22)20-19(24)21-17(16)12-5-6-14-15(9-12)27-11-26-14/h5-6,9,17H,2-4,7-8,10-11H2,1H3,(H2,20,21,24)
InChIKey
QKJTVAICJYSOAM-UHFFFAOYSA-N
Synonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC3=C(C=C2)OCO3)CN4CCCC4
ethyl4(13benzodioxol5yl)2oxo6(pyrrolidin1ylmethyl)1234tetrahydropyrimidine5carboxylate
ETHYL4(13BENZODIOXOL5YL)2OXO6(PYRROLIDIN1YLMETHYL)34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ETHYL6(2HBENZO(34D)13DIOXOLAN5YL)2OXO4(PYRROLIDINYLMETHYL)136TRIHYDROPYRIMIDINE5CARBOXYLATE
Registry IDs
MFCD05258791
ZINC000054979052
ZINC000054979053

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.