Vitas-M small molecule compound

methyl 4-[5-bromo-2-(propan-2-yloxy)phenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STL172479
SMILES COC(=O)C1=C(C)NC(=O)NC1c1cc(Br)ccc1OC(C)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 C16H19BrN2O4 MW 383.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19BrN2O4/c1-8(2)23-12-6-5-10(17)7-11(12)14-13(15(20)22-4)9(3)18-16(21)19-14/h5-8,14H,1-4H3,(H2,18,19,21)
InChIKey
VMCYQZFASMORRF-UHFFFAOYSA-N
Synonyms
444936-17-8
444936178
CC1=C(C(NC(=O)N1)C2=C(C=CC(=C2)Br)OC(C)C)C(=O)OC
InChI=1SC16H19BrN2O4c18(2)23126510(17)711(12)1413(15(20)224)9(3)1816(21)1914h5814H14H3(H2181921)
methyl4(5bromo2(propan2yloxy)phenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
METHYL4(5BROMO2PROPAN2YLOXYPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
MFCD02606172
ZINC000000679910
ZINC000000679911

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Available files

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