Vitas-M small molecule compound
5-(1,3-benzodioxol-5-ylmethyl)-5-{[(4-chlorophenyl)amino]methyl}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL010866
SMILES Clc1ccc(cc1)NCC1(Cc2ccc3c(c2)OCO3)C(=O)N(C)C(=O)N(C1=O)C
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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 C21H20ClN3O5 MW 429.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN3O5/c1-24-18(26)21(19(27)25(2)20(24)28,11-23-15-6-4-14(22)5-7-15)10-13-3-8-16-17(9-13)30-12-29-16/h3-9,23H,10-12H2,1-2H3InChIKey
BTRJYNOMXPXEDG-UHFFFAOYSA-NSynonyms
929966-80-35(13benzodioxol5ylmethyl)5(((4chlorophenyl)amino)methyl)13dimethylpyrimidine246(1H3H5H)trione
5(13benzodioxol5ylmethyl)5((4chloroanilino)methyl)13dimethyl13diazinane246trione
5(benzo(d)(13)dioxol5ylmethyl)5(((4chlorophenyl)amino)methyl)13dimethylpyrimidine246(1H3H5H)trione
929966803
CN1C(=O)C(C(=O)N(C1=O)C)(CC2=CC3=C(C=C2)OCO3)CNC4=CC=C(C=C4)Cl
InChI=1SC21H20ClN3O5c12418(26)21(19(27)25(2)20(24)281123156414(22)5715)1013381617(913)30122916h3923H1012H212H3
MFCD09849490
ZINC000013681986
ZINC13681986
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