Vitas-M small molecule compound

cyclopentyl 4-(4-bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK364145
SMILES O=C(C1=C(C)NC(=O)NC1c1ccc(cc1)Br)OC1CCCC1

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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 C17H19BrN2O3 MW 379.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19BrN2O3/c1-10-14(16(21)23-13-4-2-3-5-13)15(20-17(22)19-10)11-6-8-12(18)9-7-11/h6-9,13,15H,2-5H2,1H3,(H2,19,20,22)
InChIKey
CCWVFPDYMVJYLJ-UHFFFAOYSA-N
Synonyms

CC1=C(C(NC(=O)N1)C2=CC=C(C=C2)Br)C(=O)OC3CCCC3
cyclopentyl4(4bromophenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
CYCLOPENTYL4(4BROMOPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
CYCLOPENTYL6(4BROMOPHENYL)4METHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC17H19BrN2O3c11014(16(21)2313423513)15(2017(22)1910)116812(18)9711h691315H25H21H3(H2192022)
MFCD00396565
ZINC000000757965
ZINC000000757966

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Available files

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