Vitas-M small molecule compound
butyl 6-methyl-4-(5-nitrothiophen-2-yl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK019991
SMILES CCCCOC(=O)C1=C(C)NC(=O)NC1c1ccc(s1)[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 C14H17N3O5S MW 339.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N3O5S/c1-3-4-7-22-13(18)11-8(2)15-14(19)16-12(11)9-5-6-10(23-9)17(20)21/h5-6,12H,3-4,7H2,1-2H3,(H2,15,16,19)InChIKey
LVUPYNWNOCBPTD-UHFFFAOYSA-NSynonyms
butyl6methyl4(5nitrothiophen2yl)2oxo1234tetrahydropyrimidine5carboxylate
BUTYL6METHYL4(5NITROTHIOPHEN2YL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
CCCCOC(=O)C1=C(C)NC(=O)NC1c1ccc(s1)(N+)(=O)(O)
CCCCOC(=O)C1=C(NC(=O)NC1C2=CC=C(S2)(N+)(=O)(O))C
InChI=1SC14H17N3O5Sc13472213(18)118(2)1514(19)1612(11)95610(239)17(20)21h5612H347H212H3(H2151619)
MFCD03032685
STK019991
ZINC000003905819
ZINC000003905820
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