Vitas-M small molecule compound
ethyl 6-({[2-(4-chlorophenyl)ethyl]amino}methyl)-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK684118
SMILES CCOC(=O)C1=C(CNCCc2ccc(cc2)Cl)NC(=O)NC1c1cccc(c1)[N+](=O)[O-]
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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 C22H23ClN4O5 MW 458.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN4O5/c1-2-32-21(28)19-18(13-24-11-10-14-6-8-16(23)9-7-14)25-22(29)26-20(19)15-4-3-5-17(12-15)27(30)31/h3-9,12,20,24H,2,10-11,13H2,1H3,(H2,25,26,29)InChIKey
HOXPEGUSMMGBGG-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(CNCCc2ccc(cc2)Cl)NC(=O)NC1c1cccc(c1)(N+)(=O)(O)
CCOC(=O)C1=C(NC(=O)NC1C2=CC(=CC=C2)(N+)(=O)(O))CNCCC3=CC=C(C=C3)Cl
ethyl6(((2(4chlorophenyl)ethyl)amino)methyl)4(3nitrophenyl)2oxo1234tetrahydropyrimidine5carboxylate
ETHYL6((2(4CHLOROPHENYL)ETHYLAMINO)METHYL)4(3NITROPHENYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC22H23ClN4O5c123221(28)1918(13241110146816(23)9714)2522(29)2620(19)1543517(1215)27(30)31h39122024H2101113H21H3(H2252629)
MFCD05259662
ZINC000012412636
ZINC000012412638
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