Vitas-M small molecule compound
cyclopentyl 6-methyl-4-(4-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK083432
SMILES O=C1NC(=C(C(N1)c1ccc(cc1)[N+](=O)[O-])C(=O)OC1CCCC1)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 C17H19N3O5 MW 345.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O5/c1-10-14(16(21)25-13-4-2-3-5-13)15(19-17(22)18-10)11-6-8-12(9-7-11)20(23)24/h6-9,13,15H,2-5H2,1H3,(H2,18,19,22)InChIKey
DKRLEPYQVISEGB-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=O)N1)C2=CC=C(C=C2)(N+)(=O)(O))C(=O)OC3CCCC3
CYCLOPENTYL4METHYL6(4NITROPHENYL)2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
cyclopentyl6methyl4(4nitrophenyl)2oxo1234tetrahydropyrimidine5carboxylate
CYCLOPENTYL6METHYL4(4NITROPHENYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC17H19N3O5c11014(16(21)2513423513)15(1917(22)1810)116812(9711)20(23)24h691315H25H21H3(H2181922)
MFCD00376497
O=C1NC(=C(C(N1)c1ccc(cc1)(N+)(=O)(O))C(=O)OC1CCCC1)C
STK083432
ZINC000000044018
ZINC000000044019
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