Vitas-M small molecule compound

butyl 4-(5-bromothiophen-2-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK025857
SMILES CCCCOC(=O)C1=C(C)NC(=O)NC1c1ccc(s1)Br

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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 C14H17BrN2O3S MW 373.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17BrN2O3S/c1-3-4-7-20-13(18)11-8(2)16-14(19)17-12(11)9-5-6-10(15)21-9/h5-6,12H,3-4,7H2,1-2H3,(H2,16,17,19)
InChIKey
QVVJYDPLWQGNTC-UHFFFAOYSA-N
Synonyms

butyl4(5bromothiophen2yl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
BUTYL4(5BROMOTHIOPHEN2YL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
CCCCOC(=O)C1=C(C)NC(=O)NC1c1ccc(s1)Br
CCCCOC(=O)C1=C(NC(=O)NC1C2=CC=C(S2)Br)C
InChI=1SC14H17BrN2O3Sc13472013(18)118(2)1614(19)1712(11)95610(15)219h5612H347H212H3(H2161719)
MFCD03370899
STK025857
ZINC000004008691
ZINC000004008692

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.