Vitas-M small molecule compound
tert-butyl 4-[4-amino-5-(benzylcarbamoyl)pyrimidin-2-yl]piperazine-1-carboxylate
Catalog ID
STL167601
SMILES O=C(N1CCN(CC1)c1ncc(c(n1)N)C(=O)NCc1ccccc1)OC(C)(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 C21H28N6O3 MW 412.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N6O3/c1-21(2,3)30-20(29)27-11-9-26(10-12-27)19-24-14-16(17(22)25-19)18(28)23-13-15-7-5-4-6-8-15/h4-8,14H,9-13H2,1-3H3,(H,23,28)(H2,22,24,25)InChIKey
DAJZBMJIIGXXNC-UHFFFAOYSA-NSynonyms
1251629-61-41251629614
CC(C)(C)OC(=O)N1CCN(CC1)C2=NC=C(C(=N2)N)C(=O)NCC3=CC=CC=C3
InChI=1SC21H28N6O3c121(23)3020(29)2711926(101227)19241416(17(22)2519)18(28)2313157546815h4814H913H213H3(H2328)(H2222425)
MFCD20752011
tertbutyl4(4amino5(benzylcarbamoyl)pyrimidin2yl)piperazine1carboxylate
ZINC000049401514
ZINC49401514
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