Vitas-M small molecule compound
ethyl 6-(2,3-dihydro-1H-indol-1-ylmethyl)-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK776060
SMILES CCOC(=O)C1=C(NC(=O)NC1c1cccc(c1)[N+](=O)[O-])CN1CCc2c1cccc2
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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 C22H22N4O5 MW 422.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O5/c1-2-31-21(27)19-17(13-25-11-10-14-6-3-4-9-18(14)25)23-22(28)24-20(19)15-7-5-8-16(12-15)26(29)30/h3-9,12,20H,2,10-11,13H2,1H3,(H2,23,24,28)InChIKey
KDFPCOWGDKRZJD-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1c1cccc(c1)(N+)(=O)(O))CN1CCc2c1cccc2
CCOC(=O)C1=C(NC(=O)NC1C2=CC(=CC=C2)(N+)(=O)(O))CN3CCC4=CC=CC=C43
ethyl6(23dihydro1Hindol1ylmethyl)4(3nitrophenyl)2oxo1234tetrahydropyrimidine5carboxylate
ETHYL6(23DIHYDROINDOL1YLMETHYL)4(3NITROPHENYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC22H22N4O5c123121(27)1917(1325111014634918(14)25)2322(28)2420(19)1575816(1215)26(29)30h391220H2101113H21H3(H2232428)
MFCD05258453
ZINC000001067483
ZINC000001067487
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